4-(((4-(BENZO[3,4-D]1,3-DIOXOLAN-5-YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZENECARBONITRILE
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![4-(((4-(BENZO[3,4-D]1,3-DIOXOLAN-5-YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZENECARBONITRILE structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ac6360a4a7dc47f1bddab0971ac9c448.png "4-(((4-(BENZO[3,4-D]1,3-DIOXOLAN-5-YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZENECARBONITRILE")
4-(((4-(BENZO[3,4-D]1,3-DIOXOLAN-5-YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZENECARBONITRILE
structure -
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CAS No:
497060-95-4
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Formula:
C20H20N4O2S
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Chemical Name:
4-(((4-(BENZO[3,4-D]1,3-DIOXOLAN-5-YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZENECARBONITRILE
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Synonyms:
4-(((4-(BENZO[3,4-D]1,3-DIOXOLAN-5-YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZENECARBONITRILE;497060-95-4;Oprea1_755012;CTK7C7920;KS-000029FN;ZINC35622992;AKOS022169407;MS-8141;4-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(4-cyanophenyl)piperazine-1-carbothioamide
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CAS No:
4-(((4-(BENZO[3,4-D]1,3-DIOXOLAN-5-YLMETHYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZENECARBONITRILE Basic Attributes
380.46
380.131
Computed Properties
Molecular Weight:380.5
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:380.13069707
Monoisotopic Mass:380.13069707
Topological Polar Surface Area:92.8
Heavy Atom Count:27
Complexity:564
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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