2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone

Systemtic Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone Openeye Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-1-(5-nitroindolin-1-yl)ethanone CAS Name: 2-[methyl-[[4-(methylthio)phenyl]methyl]amino]-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone IUPAC Name: 2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-[methyl-[4-(methylthio)benzyl]amino]-1-(5-nitroindolin-1-yl)ethanone Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CC(=O)N2CCC3=C2C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CC(=O)N2CCC3=C2C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3S/c1-20(12-14-3-6-17(26-2)7-4-14)13-19(23)21-10-9-15-11-16(22(24)25)5-8-18(15)21/h3-8,11H,9-10,12-13H2,1-2H3