N-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-4-methoxy-benzamide

Systemtic Name: N-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-4-methoxy-benzamide Openeye Name: N-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]-4-methoxy-benzamide CAS Name: N-[2-[[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-4-methoxybenzamide IUPAC Name: N-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]-4-methoxybenzamide Traditional Name: N-[2-[[2-(homoveratrylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]-4-methoxy-benzamide Formula: C28H28N4O6S MolecularWeight: 548.61012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C28H28N4O6S/c1-36-20-11-9-19(10-12-20)26(34)31-32-27(35)21-6-4-5-7-22(21)30-28(32)39-17-25(33)29-15-14-18-8-13-23(37-2)24(16-18)38-3/h4-13,16H,14-15,17H2,1-3H3,(H,29,33)(H,31,34)