ethyl 3-[(phenylmethyl)-[(3-propan-2-yloxyphenyl)carbonylcarbamothioyl]amino]propanoate

Systemtic Name: ethyl 3-[(phenylmethyl)-[(3-propan-2-yloxyphenyl)carbonylcarbamothioyl]amino]propanoate Openeye Name: ethyl 3-[benzyl-[(3-isopropoxybenzoyl)carbamothioyl]amino]propanoate CAS Name: 3-[[[[oxo-(3-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[(3-propan-2-yloxybenzoyl)carbamothioyl]amino]propanoate Traditional Name: 3-[benzyl-[(3-isopropoxybenzoyl)thiocarbamoyl]amino]propionic acid ethyl ester Formula: C23H28N2O4S MolecularWeight: 428.54442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC(=CC=C2)OC(C)C

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC(=CC=C2)OC(C)C

InChI

InChI=1S/C23H28N2O4S/c1-4-28-21(26)13-14-25(16-18-9-6-5-7-10-18)23(30)24-22(27)19-11-8-12-20(15-19)29-17(2)3/h5-12,15,17H,4,13-14,16H2,1-3H3,(H,24,27,30)