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

Systemtic Name: N-[(2R)-1-(cyclopropylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1R)-1-(cyclopropylcarbamoyl)-3-methylsulfanyl-propyl]-3-nitro-benzamide CAS Name: N-[(2R)-1-(cyclopropylamino)-4-(methylthio)-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2R)-1-(cyclopropylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1R)-1-(cyclopropylcarbamoyl)-3-(methylthio)propyl]-3-nitro-benzamide Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1CC1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CSCC[C@H](C(=O)NC1CC1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O4S/c1-23-8-7-13(15(20)16-11-5-6-11)17-14(19)10-3-2-4-12(9-10)18(21)22/h2-4,9,11,13H,5-8H2,1H3,(H,16,20)(H,17,19)/t13-/m1/s1