2-[2-[(4-acetamidophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-[(4-acetamidophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-[(4-acetamidophenyl)methylamino]-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-[(4-acetamidophenyl)methylamino]-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-[(4-acetamidophenyl)methylamino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-[(4-acetamidobenzyl)amino]-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C18H22N4O4S MolecularWeight: 390.45668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C18H22N4O4S/c1-11-8-16(22-26-11)21-18(25)12(2)27-10-17(24)19-9-14-4-6-15(7-5-14)20-13(3)23/h4-8,12H,9-10H2,1-3H3,(H,19,24)(H,20,23)(H,21,22,25)