3-azanyl-2-cyano-N-phenyl-3-(4-phenylpiperazin-1-yl)prop-2-enethioamide

Systemtic Name: 3-azanyl-2-cyano-N-phenyl-3-(4-phenylpiperazin-1-yl)prop-2-enethioamide Openeye Name: 3-amino-2-cyano-N-phenyl-3-(4-phenylpiperazin-1-yl)prop-2-enethioamide CAS Name: 3-amino-2-cyano-N-phenyl-3-(4-phenyl-1-piperazinyl)-2-propenethioamide IUPAC Name: 3-amino-2-cyano-N-phenyl-3-(4-phenylpiperazin-1-yl)prop-2-enethioamide Traditional Name: 3-amino-2-cyano-N-phenyl-3-(4-phenylpiperazino)thioacrylamide Formula: C20H21N5S MolecularWeight: 363.47924

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=C(C#N)C(=S)NC3=CC=CC=C3)N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=C(C#N)C(=S)NC3=CC=CC=C3)N

InChI

InChI=1S/C20H21N5S/c21-15-18(20(26)23-16-7-3-1-4-8-16)19(22)25-13-11-24(12-14-25)17-9-5-2-6-10-17/h1-10H,11-14,22H2,(H,23,26)