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

Systemtic Name: 2-[2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N-phenyl-benzamide Openeye Name: 2-[[2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N-phenyl-benzamide CAS Name: 2-[[2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[[2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-N-phenylbenzamide Traditional Name: 2-[[2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N-phenyl-benzamide Formula: C26H22N4O3S MolecularWeight: 470.54288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C26H22N4O3S/c31-23(28-21-12-6-4-10-19(21)24(32)27-17-8-2-1-3-9-17)16-34-26-29-22-13-7-5-11-20(22)25(33)30(26)18-14-15-18/h1-13,18H,14-16H2,(H,27,32)(H,28,31)