[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-(4-methylsulfanyl-3-nitro-phenyl)methanone

Systemtic Name: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-(4-methylsulfanyl-3-nitro-phenyl)methanone Openeye Name: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-(4-methylsulfanyl-3-nitro-phenyl)methanone CAS Name: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-[4-(methylthio)-3-nitrophenyl]methanone IUPAC Name: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-(4-methylsulfanyl-3-nitrophenyl)methanone Traditional Name: [4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]-[4-(methylthio)-3-nitro-phenyl]methanone Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)N2CCC(=CC2)C3=CNC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)N2CCC(=CC2)C3=CNC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O3S/c1-28-20-7-6-15(12-19(20)24(26)27)21(25)23-10-8-14(9-11-23)17-13-22-18-5-3-2-4-16(17)18/h2-8,12-13,22H,9-11H2,1H3