methyl (2R)-4-methylsulfanyl-2-[[4-[(propan-2-ylcarbamoylamino)methyl]phenyl]carbonylamino]butanoate

Systemtic Name: methyl (2R)-4-methylsulfanyl-2-[[4-[(propan-2-ylcarbamoylamino)methyl]phenyl]carbonylamino]butanoate Openeye Name: methyl (2R)-2-[[4-[(isopropylcarbamoylamino)methyl]benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-4-(methylthio)-2-[[oxo-[4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]phenyl]methyl]amino]butanoic acid methyl ester IUPAC Name: methyl (2R)-4-methylsulfanyl-2-[[4-[(propan-2-ylcarbamoylamino)methyl]benzoyl]amino]butanoate Traditional Name: (2R)-2-[[4-[(isopropylcarbamoylamino)methyl]benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C18H27N3O4S MolecularWeight: 381.48968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C18H27N3O4S/c1-12(2)20-18(24)19-11-13-5-7-14(8-6-13)16(22)21-15(9-10-26-4)17(23)25-3/h5-8,12,15H,9-11H2,1-4H3,(H,21,22)(H2,19,20,24)/t15-/m1/s1