ethyl 2-[4-oxidanylidene-3-[[4-[(phenylmethyl)carbamoyl]cyclohexyl]methyl]quinazolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-oxidanylidene-3-[[4-[(phenylmethyl)carbamoyl]cyclohexyl]methyl]quinazolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[3-[[4-(benzylcarbamoyl)cyclohexyl]methyl]-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[4-oxo-3-[[4-[oxo-[(phenylmethyl)amino]methyl]cyclohexyl]methyl]-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[[4-(benzylcarbamoyl)cyclohexyl]methyl]-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-[[4-(benzylcarbamoyl)cyclohexyl]methyl]-4-keto-quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3CCC(CC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3CCC(CC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4S/c1-2-34-24(31)18-35-27-29-23-11-7-6-10-22(23)26(33)30(27)17-20-12-14-21(15-13-20)25(32)28-16-19-8-4-3-5-9-19/h3-11,20-21H,2,12-18H2,1H3,(H,28,32)