1-[2-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-pentyl-quinazolin-7-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-pentyl-quinazolin-7-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-[2-(4-ethoxyanilino)-2-oxo-ethyl]sulfanyl-4-oxo-3-pentyl-quinazoline-7-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-[[2-(4-ethoxyanilino)-2-oxoethyl]thio]-4-oxo-3-pentyl-7-quinazolinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-4-oxo-3-pentylquinazoline-7-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[3-amyl-4-keto-2-[[2-keto-2-(p-phenetidino)ethyl]thio]quinazoline-7-carbonyl]isonipecotamide Formula: C30H37N5O5S MolecularWeight: 579.71028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)C(=O)N)N=C1SCC(=O)NC4=CC=C(C=C4)OCC

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)C(=O)N)N=C1SCC(=O)NC4=CC=C(C=C4)OCC

InChI

InChI=1S/C30H37N5O5S/c1-3-5-6-15-35-29(39)24-12-7-21(28(38)34-16-13-20(14-17-34)27(31)37)18-25(24)33-30(35)41-19-26(36)32-22-8-10-23(11-9-22)40-4-2/h7-12,18,20H,3-6,13-17,19H2,1-2H3,(H2,31,37)(H,32,36)