[1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 5-chloranylthiophene-2-carboxylate

Systemtic Name: [1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 5-chloranylthiophene-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-(1-phenylbutylamino)ethyl] 5-chlorothiophene-2-carboxylate CAS Name: 5-chloro-2-thiophenecarboxylic acid [1-oxo-1-(1-phenylbutylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylbutylamino)propan-2-yl] 5-chlorothiophene-2-carboxylate Traditional Name: 5-chlorothiophene-2-carboxylic acid [2-keto-1-methyl-2-(1-phenylbutylamino)ethyl] ester Formula: C18H20ClNO3S MolecularWeight: 365.8743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C18H20ClNO3S/c1-3-7-14(13-8-5-4-6-9-13)20-17(21)12(2)23-18(22)15-10-11-16(19)24-15/h4-6,8-12,14H,3,7H2,1-2H3,(H,20,21)