(2S)-2-[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]-N-[(2,4-dichlorophenyl)methyl]-3-methyl-pentanamide

Systemtic Name: (2S)-2-[[(2R)-2-azanyl-3-sulfanyl-propyl]amino]-N-[(2,4-dichlorophenyl)methyl]-3-methyl-pentanamide Openeye Name: (2S)-2-[[(2R)-2-amino-3-sulfanyl-propyl]amino]-N-[(2,4-dichlorophenyl)methyl]-3-methyl-pentanamide CAS Name: (2S)-2-[[(2R)-2-amino-3-mercaptopropyl]amino]-N-[(2,4-dichlorophenyl)methyl]-3-methylpentanamide IUPAC Name: (2S)-2-[[(2R)-2-amino-3-sulfanylpropyl]amino]-N-[(2,4-dichlorophenyl)methyl]-3-methylpentanamide Traditional Name: (2S)-2-[[(2R)-2-amino-3-mercapto-propyl]amino]-N-(2,4-dichlorobenzyl)-3-methyl-valeramide Formula: C16H25Cl2N3OS MolecularWeight: 378.3602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC1=C(C=C(C=C1)Cl)Cl)NCC(CS)N

Isomeric SMILES

CCC(C)[C@@H](C(=O)NCC1=C(C=C(C=C1)Cl)Cl)NC[C@H](CS)N

InChI

InChI=1S/C16H25Cl2N3OS/c1-3-10(2)15(20-8-13(19)9-23)16(22)21-7-11-4-5-12(17)6-14(11)18/h4-6,10,13,15,20,23H,3,7-9,19H2,1-2H3,(H,21,22)/t10?,13-,15+/m1/s1