N-[(2R)-4-methylsulfanyl-1-[(4-methylsulfanylphenyl)amino]-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(2R)-4-methylsulfanyl-1-[(4-methylsulfanylphenyl)amino]-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1R)-3-methylsulfanyl-1-[(4-methylsulfanylphenyl)carbamoyl]propyl]-3-nitro-benzamide CAS Name: N-[(2R)-4-(methylthio)-1-[4-(methylthio)anilino]-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2R)-4-methylsulfanyl-1-(4-methylsulfanylanilino)-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1R)-3-(methylthio)-1-[[4-(methylthio)phenyl]carbamoyl]propyl]-3-nitro-benzamide Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)SC)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSCC[C@H](C(=O)NC1=CC=C(C=C1)SC)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4S2/c1-27-11-10-17(19(24)20-14-6-8-16(28-2)9-7-14)21-18(23)13-4-3-5-15(12-13)22(25)26/h3-9,12,17H,10-11H2,1-2H3,(H,20,24)(H,21,23)/t17-/m1/s1