4-[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-[cyclohexyl(methyl)amino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-[cyclohexyl(methyl)amino]-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCCC1)C(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O4S/c1-18(12-5-3-2-4-6-12)15(20)10-24-14-8-7-11(16(17)21)9-13(14)19(22)23/h7-9,12H,2-6,10H2,1H3,(H2,17,21)