(E)-N-[2-(1H-indol-3-yl)ethyl]-3-(3-nitro-4-pyridin-2-ylsulfanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(1H-indol-3-yl)ethyl]-3-(3-nitro-4-pyridin-2-ylsulfanyl-phenyl)prop-2-enamide Openeye Name: (E)-N-[2-(1H-indol-3-yl)ethyl]-3-[3-nitro-4-(2-pyridylsulfanyl)phenyl]prop-2-enamide CAS Name: (E)-N-[2-(1H-indol-3-yl)ethyl]-3-[3-nitro-4-(2-pyridinylthio)phenyl]-2-propenamide IUPAC Name: (E)-N-[2-(1H-indol-3-yl)ethyl]-3-(3-nitro-4-pyridin-2-ylsulfanylphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(1H-indol-3-yl)ethyl]-3-[3-nitro-4-(2-pyridylthio)phenyl]acrylamide Formula: C24H20N4O3S MolecularWeight: 444.5056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)C=CC3=CC(=C(C=C3)SC4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)/C=C/C3=CC(=C(C=C3)SC4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O3S/c29-23(25-14-12-18-16-27-20-6-2-1-5-19(18)20)11-9-17-8-10-22(21(15-17)28(30)31)32-24-7-3-4-13-26-24/h1-11,13,15-16,27H,12,14H2,(H,25,29)/b11-9+