2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-4-methylsulfanyl-butanamide

Systemtic Name: 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-4-methylsulfanyl-butanamide Openeye Name: 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-4-methylsulfanyl-N-(p-tolyl)butanamide CAS Name: 2-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]-N-(4-methylphenyl)-4-(methylthio)butanamide IUPAC Name: 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-N-(4-methylphenyl)-4-methylsulfanylbutanamide Traditional Name: 2-[[2-chloroethyl(nitroso)carbamoyl]amino]-4-(methylthio)-N-(p-tolyl)butyramide Formula: C15H21ClN4O3S MolecularWeight: 372.87024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)N(CCCl)N=O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C15H21ClN4O3S/c1-11-3-5-12(6-4-11)17-14(21)13(7-10-24-2)18-15(22)20(19-23)9-8-16/h3-6,13H,7-10H2,1-2H3,(H,17,21)(H,18,22)