4-[[(2S)-2-[(4-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoyl]amino]-N-methyl-benzamide

Systemtic Name: 4-[[(2S)-2-[(4-chlorophenyl)carbonylamino]-4-methylsulfanyl-butanoyl]amino]-N-methyl-benzamide Openeye Name: 4-[[(2S)-2-[(4-chlorobenzoyl)amino]-4-methylsulfanyl-butanoyl]amino]-N-methyl-benzamide CAS Name: 4-[[(2S)-2-[[(4-chlorophenyl)-oxomethyl]amino]-4-(methylthio)-1-oxobutyl]amino]-N-methylbenzamide IUPAC Name: 4-[[(2S)-2-[(4-chlorobenzoyl)amino]-4-methylsulfanylbutanoyl]amino]-N-methylbenzamide Traditional Name: 4-[[(2S)-2-[(4-chlorobenzoyl)amino]-4-(methylthio)butanoyl]amino]-N-methyl-benzamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H22ClN3O3S/c1-22-18(25)13-5-9-16(10-6-13)23-20(27)17(11-12-28-2)24-19(26)14-3-7-15(21)8-4-14/h3-10,17H,11-12H2,1-2H3,(H,22,25)(H,23,27)(H,24,26)/t17-/m0/s1