methyl 2-naphthalen-1-yl-2-[[4-oxidanylidene-2-(phenylmethyl)pentanethioyl]amino]ethanoate

Systemtic Name: methyl 2-naphthalen-1-yl-2-[[4-oxidanylidene-2-(phenylmethyl)pentanethioyl]amino]ethanoate Openeye Name: methyl 2-[(2-benzyl-4-oxo-pentanethioyl)amino]-2-(1-naphthyl)acetate CAS Name: 2-(1-naphthalenyl)-2-[[4-oxo-2-(phenylmethyl)-1-sulfanylidenepentyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(2-benzyl-4-oxopentanethioyl)amino]-2-naphthalen-1-ylacetate Traditional Name: 2-[(2-benzyl-4-keto-pentanethioyl)amino]-2-(1-naphthyl)acetic acid methyl ester Formula: C25H25NO3S MolecularWeight: 419.5359

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CC1=CC=CC=C1)C(=S)NC(C2=CC=CC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC(=O)CC(CC1=CC=CC=C1)C(=S)NC(C2=CC=CC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C25H25NO3S/c1-17(27)15-20(16-18-9-4-3-5-10-18)24(30)26-23(25(28)29-2)22-14-8-12-19-11-6-7-13-21(19)22/h3-14,20,23H,15-16H2,1-2H3,(H,26,30)