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

Systemtic Name: N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-[(3-nitrophenyl)methylsulfanyl]-4-oxo-quinazoline-7-carboxamide CAS Name: N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-[(3-nitrophenyl)methylthio]-4-oxo-7-quinazolinecarboxamide IUPAC Name: N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-[(3-nitrophenyl)methylsulfanyl]-4-oxoquinazoline-7-carboxamide Traditional Name: 4-keto-N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-[(3-nitrobenzyl)thio]quinazoline-7-carboxamide Formula: C26H24N4O6S MolecularWeight: 520.55696

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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)[N+](=O)[O-])C4=CC(=CC=C4)OC

Isomeric SMILES

COCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)[N+](=O)[O-])C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H24N4O6S/c1-35-12-11-27-24(31)18-9-10-22-23(14-18)28-26(37-16-17-5-3-7-20(13-17)30(33)34)29(25(22)32)19-6-4-8-21(15-19)36-2/h3-10,13-15H,11-12,16H2,1-2H3,(H,27,31)