methyl 4-[2-[(2-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(2-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)thio]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2-oxo-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(2-keto-5,6,7,8-tetrahydro-1H-quinazolin-4-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)NC3=C2CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)NC3=C2CCCC3

InChI

InChI=1S/C18H19N3O4S/c1-25-17(23)11-6-8-12(9-7-11)19-15(22)10-26-16-13-4-2-3-5-14(13)20-18(24)21-16/h6-9H,2-5,10H2,1H3,(H,19,22)(H,20,21,24)