N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]butanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]butanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-(3-methoxypropylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]butanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[[2-(3-methoxypropylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]butanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-[2-(3-methoxypropylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide Traditional Name: N-homoveratryl-4-[4-keto-2-[[2-keto-2-(3-methoxypropylamino)ethyl]thio]quinazolin-3-yl]butyramide Formula: C28H36N4O6S MolecularWeight: 556.67364

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C28H36N4O6S/c1-36-17-7-14-29-26(34)19-39-28-31-22-9-5-4-8-21(22)27(35)32(28)16-6-10-25(33)30-15-13-20-11-12-23(37-2)24(18-20)38-3/h4-5,8-9,11-12,18H,6-7,10,13-17,19H2,1-3H3,(H,29,34)(H,30,33)