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

Systemtic Name: (E)-3-azanyl-2-cyano-N-methyl-3-(4-phenylpiperazin-1-yl)prop-2-enethioamide Openeye Name: (E)-3-amino-2-cyano-N-methyl-3-(4-phenylpiperazin-1-yl)prop-2-enethioamide CAS Name: (E)-3-amino-2-cyano-N-methyl-3-(4-phenyl-1-piperazinyl)-2-propenethioamide IUPAC Name: (E)-3-amino-2-cyano-N-methyl-3-(4-phenylpiperazin-1-yl)prop-2-enethioamide Traditional Name: (E)-3-amino-2-cyano-N-methyl-3-(4-phenylpiperazino)thioacrylamide Formula: C15H19N5S MolecularWeight: 301.40986

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C(=C(N)N1CCN(CC1)C2=CC=CC=C2)C#N

Isomeric SMILES

CNC(=S)/C(=C(\N)/N1CCN(CC1)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C15H19N5S/c1-18-15(21)13(11-16)14(17)20-9-7-19(8-10-20)12-5-3-2-4-6-12/h2-6H,7-10,17H2,1H3,(H,18,21)/b14-13+