N-cyclopropyl-2-[2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanylethanoylamino]benzamide

Systemtic Name: N-cyclopropyl-2-[2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 2-[[2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N-cyclopropyl-benzamide CAS Name: N-cyclopropyl-2-[[1-oxo-2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]ethyl]amino]benzamide IUPAC Name: 2-[[2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-N-cyclopropylbenzamide Traditional Name: 2-[[2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N-cyclopropyl-benzamide Formula: C27H24N4O3S MolecularWeight: 484.56946

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C27H24N4O3S/c32-24(29-22-12-6-4-10-20(22)25(33)28-19-14-15-19)17-35-27-30-23-13-7-5-11-21(23)26(34)31(27)16-18-8-2-1-3-9-18/h1-13,19H,14-17H2,(H,28,33)(H,29,32)