2-(aminocarbonylamino)-N-(3-chloranyl-4-methoxy-phenyl)-4-methylsulfanyl-butanamide

Systemtic Name: 2-(aminocarbonylamino)-N-(3-chloranyl-4-methoxy-phenyl)-4-methylsulfanyl-butanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-4-methylsulfanyl-2-ureido-butanamide CAS Name: 2-(carbamoylamino)-N-(3-chloro-4-methoxyphenyl)-4-(methylthio)butanamide IUPAC Name: 2-(carbamoylamino)-N-(3-chloro-4-methoxyphenyl)-4-methylsulfanylbutanamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-4-(methylthio)-2-ureido-butyramide Formula: C13H18ClN3O3S MolecularWeight: 331.81832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(CCSC)NC(=O)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C(CCSC)NC(=O)N)Cl

InChI

InChI=1S/C13H18ClN3O3S/c1-20-11-4-3-8(7-9(11)14)16-12(18)10(5-6-21-2)17-13(15)19/h3-4,7,10H,5-6H2,1-2H3,(H,16,18)(H3,15,17,19)