methyl 3-butyl-2-[2-(1-ethyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-butyl-2-[2-(1-ethyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-butyl-2-[2-(1-ethyl-2-phenyl-indol-3-yl)-2-oxo-ethyl]sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-butyl-2-[[2-(1-ethyl-2-phenyl-3-indolyl)-2-oxoethyl]thio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-butyl-2-[2-(1-ethyl-2-phenylindol-3-yl)-2-oxoethyl]sulfanyl-4-oxoquinazoline-7-carboxylate Traditional Name: 3-butyl-2-[[2-(1-ethyl-2-phenyl-indol-3-yl)-2-keto-ethyl]thio]-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C32H31N3O4S MolecularWeight: 553.67124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=O)C3=C(N(C4=CC=CC=C43)CC)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=O)C3=C(N(C4=CC=CC=C43)CC)C5=CC=CC=C5

InChI

InChI=1S/C32H31N3O4S/c1-4-6-18-35-30(37)23-17-16-22(31(38)39-3)19-25(23)33-32(35)40-20-27(36)28-24-14-10-11-15-26(24)34(5-2)29(28)21-12-8-7-9-13-21/h7-17,19H,4-6,18,20H2,1-3H3