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

Systemtic Name: N-cyclopropyl-3-[2-[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]benzamide Openeye Name: N-cyclopropyl-3-[[2-[3-(2-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]benzamide CAS Name: N-cyclopropyl-3-[[2-[[3-(2-ethylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-3-[[2-[3-(2-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]benzamide Traditional Name: N-cyclopropyl-3-[[2-[[3-(2-ethylphenyl)-4-keto-quinazolin-2-yl]thio]acetyl]amino]benzamide Formula: C28H26N4O3S MolecularWeight: 498.59604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC(=C4)C(=O)NC5CC5

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC(=C4)C(=O)NC5CC5

InChI

InChI=1S/C28H26N4O3S/c1-2-18-8-3-6-13-24(18)32-27(35)22-11-4-5-12-23(22)31-28(32)36-17-25(33)29-21-10-7-9-19(16-21)26(34)30-20-14-15-20/h3-13,16,20H,2,14-15,17H2,1H3,(H,29,33)(H,30,34)