(E)-2-cyano-3-[1-[(4-nitrophenyl)methyl]indol-3-yl]prop-2-enethioamide

Systemtic Name: (E)-2-cyano-3-[1-[(4-nitrophenyl)methyl]indol-3-yl]prop-2-enethioamide Openeye Name: (E)-2-cyano-3-[1-[(4-nitrophenyl)methyl]indol-3-yl]prop-2-enethioamide CAS Name: (E)-2-cyano-3-[1-[(4-nitrophenyl)methyl]-3-indolyl]-2-propenethioamide IUPAC Name: (E)-2-cyano-3-[1-[(4-nitrophenyl)methyl]indol-3-yl]prop-2-enethioamide Traditional Name: (E)-2-cyano-3-[1-(4-nitrobenzyl)indol-3-yl]thioacrylamide Formula: C19H14N4O2S MolecularWeight: 362.40506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)[N+](=O)[O-])C=C(C#N)C(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)[N+](=O)[O-])/C=C(\C#N)/C(=S)N

InChI

InChI=1S/C19H14N4O2S/c20-10-14(19(21)26)9-15-12-22(18-4-2-1-3-17(15)18)11-13-5-7-16(8-6-13)23(24)25/h1-9,12H,11H2,(H2,21,26)/b14-9+