N-(2-methoxyethyl)-3-(4-methoxyphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: N-(2-methoxyethyl)-3-(4-methoxyphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: N-(2-methoxyethyl)-3-(4-methoxyphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-4-oxo-quinazoline-7-carboxamide CAS Name: N-(2-methoxyethyl)-3-(4-methoxyphenyl)-2-[(3-methoxyphenyl)methylthio]-4-oxo-7-quinazolinecarboxamide IUPAC Name: N-(2-methoxyethyl)-3-(4-methoxyphenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxamide Traditional Name: 4-keto-2-(m-anisylthio)-N-(2-methoxyethyl)-3-(4-methoxyphenyl)quinazoline-7-carboxamide Formula: C27H27N3O5S MolecularWeight: 505.58538

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)OC)C4=CC=C(C=C4)OC

Isomeric SMILES

COCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H27N3O5S/c1-33-14-13-28-25(31)19-7-12-23-24(16-19)29-27(36-17-18-5-4-6-22(15-18)35-3)30(26(23)32)20-8-10-21(34-2)11-9-20/h4-12,15-16H,13-14,17H2,1-3H3,(H,28,31)