methyl 2-[1-[bis(2-phenylethanoyl)carbamothioyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[bis(2-phenylethanoyl)carbamothioyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-[bis(2-phenylacetyl)carbamothioyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[[bis(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[bis(2-phenylacetyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[bis(2-phenylacetyl)thiocarbamoyl]-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1C(=S)N(C(=O)CC2=CC=CC=C2)C(=O)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC1C(=O)NCCN1C(=S)N(C(=O)CC2=CC=CC=C2)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C24H25N3O5S/c1-32-22(30)16-19-23(31)25-12-13-26(19)24(33)27(20(28)14-17-8-4-2-5-9-17)21(29)15-18-10-6-3-7-11-18/h2-11,19H,12-16H2,1H3,(H,25,31)