ethyl 3-[[2-(2-methylpropoxy)phenyl]carbonylcarbamothioyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[[2-(2-methylpropoxy)phenyl]carbonylcarbamothioyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-[(2-isobutoxybenzoyl)carbamothioyl]amino]propanoate CAS Name: 3-[[[[[2-(2-methylpropoxy)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[[2-(2-methylpropoxy)benzoyl]carbamothioyl]amino]propanoate Traditional Name: 3-[benzyl-[(2-isobutoxybenzoyl)thiocarbamoyl]amino]propionic acid ethyl ester Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC=CC=C2OCC(C)C

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC=CC=C2OCC(C)C

InChI

InChI=1S/C24H30N2O4S/c1-4-29-22(27)14-15-26(16-19-10-6-5-7-11-19)24(31)25-23(28)20-12-8-9-13-21(20)30-17-18(2)3/h5-13,18H,4,14-17H2,1-3H3,(H,25,28,31)