N-methyl-4-(2-methylpropylsulfanyl)-3-nitro-N-(phenylmethyl)benzamide

Systemtic Name: N-methyl-4-(2-methylpropylsulfanyl)-3-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-isobutylsulfanyl-N-methyl-3-nitro-benzamide CAS Name: N-methyl-4-(2-methylpropylthio)-3-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-methyl-4-(2-methylpropylsulfanyl)-3-nitrobenzamide Traditional Name: N-benzyl-4-(isobutylthio)-N-methyl-3-nitro-benzamide Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=C(C=C(C=C1)C(=O)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CSC1=C(C=C(C=C1)C(=O)N(C)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H22N2O3S/c1-14(2)13-25-18-10-9-16(11-17(18)21(23)24)19(22)20(3)12-15-7-5-4-6-8-15/h4-11,14H,12-13H2,1-3H3