4-[[2-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]methyl]-N-pentyl-benzamide

Systemtic Name: 4-[[2-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]methyl]-N-pentyl-benzamide Openeye Name: 4-[[2-[2-(4-ethylanilino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]methyl]-N-pentyl-benzamide CAS Name: 4-[[2-[[2-(4-ethylanilino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]methyl]-N-pentylbenzamide IUPAC Name: 4-[[2-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]methyl]-N-pentylbenzamide Traditional Name: N-amyl-4-[[2-[[2-(4-ethylanilino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]methyl]benzamide Formula: C31H34N4O3S MolecularWeight: 542.69166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)CC

Isomeric SMILES

CCCCCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)CC

InChI

InChI=1S/C31H34N4O3S/c1-3-5-8-19-32-29(37)24-15-11-23(12-16-24)20-35-30(38)26-9-6-7-10-27(26)34-31(35)39-21-28(36)33-25-17-13-22(4-2)14-18-25/h6-7,9-18H,3-5,8,19-21H2,1-2H3,(H,32,37)(H,33,36)