(Z)-2-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]-3-(2-oxidanylidenepropylsulfanyl)-3-phenylazanyl-prop-2-enenitrile

Systemtic Name: (Z)-2-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]-3-(2-oxidanylidenepropylsulfanyl)-3-phenylazanyl-prop-2-enenitrile Openeye Name: (Z)-3-acetonylsulfanyl-3-anilino-2-[4-(benzofuran-2-yl)thiazol-2-yl]prop-2-enenitrile CAS Name: (Z)-3-anilino-2-[4-(2-benzofuranyl)-2-thiazolyl]-3-(2-oxopropylthio)-2-propenenitrile IUPAC Name: (Z)-3-anilino-2-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]-3-(2-oxopropylsulfanyl)prop-2-enenitrile Traditional Name: (Z)-3-(acetonylthio)-3-anilino-2-[4-(benzofuran-2-yl)thiazol-2-yl]acrylonitrile Formula: C23H17N3O2S2 MolecularWeight: 431.52998

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC(=C(C#N)C1=NC(=CS1)C2=CC3=CC=CC=C3O2)NC4=CC=CC=C4

Isomeric SMILES

CC(=O)CS/C(=C(/C#N)\C1=NC(=CS1)C2=CC3=CC=CC=C3O2)/NC4=CC=CC=C4

InChI

InChI=1S/C23H17N3O2S2/c1-15(27)13-29-22(25-17-8-3-2-4-9-17)18(12-24)23-26-19(14-30-23)21-11-16-7-5-6-10-20(16)28-21/h2-11,14,25H,13H2,1H3/b22-18-