ethyl 2-[[4-oxidanylidene-2-(phenylmethyl)pentanethioyl]amino]-2-(1,3-thiazol-4-yl)ethanoate

Systemtic Name: ethyl 2-[[4-oxidanylidene-2-(phenylmethyl)pentanethioyl]amino]-2-(1,3-thiazol-4-yl)ethanoate Openeye Name: ethyl 2-[(2-benzyl-4-oxo-pentanethioyl)amino]-2-thiazol-4-yl-acetate CAS Name: 2-[[4-oxo-2-(phenylmethyl)-1-sulfanylidenepentyl]amino]-2-(4-thiazolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-[(2-benzyl-4-oxopentanethioyl)amino]-2-(1,3-thiazol-4-yl)acetate Traditional Name: 2-[(2-benzyl-4-keto-pentanethioyl)amino]-2-thiazol-4-yl-acetic acid ethyl ester Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CSC=N1)NC(=S)C(CC2=CC=CC=C2)CC(=O)C

Isomeric SMILES

CCOC(=O)C(C1=CSC=N1)NC(=S)C(CC2=CC=CC=C2)CC(=O)C

InChI

InChI=1S/C19H22N2O3S2/c1-3-24-19(23)17(16-11-26-12-20-16)21-18(25)15(9-13(2)22)10-14-7-5-4-6-8-14/h4-8,11-12,15,17H,3,9-10H2,1-2H3,(H,21,25)