N-(4-ethylphenyl)-2-[3-(furan-2-ylmethyl)-6,7-dimethoxy-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide

Systemtic Name: N-(4-ethylphenyl)-2-[3-(furan-2-ylmethyl)-6,7-dimethoxy-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-(4-ethylphenyl)-2-[3-(2-furylmethyl)-6,7-dimethoxy-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-(4-ethylphenyl)-2-[[3-(2-furanylmethyl)-6,7-dimethoxy-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-(4-ethylphenyl)-2-[3-(furan-2-ylmethyl)-6,7-dimethoxy-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-(4-ethylphenyl)-2-[[3-(2-furfuryl)-4-keto-6,7-dimethoxy-quinazolin-2-yl]thio]butyramide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(CC)SC2=NC3=CC(=C(C=C3C(=O)N2CC4=CC=CO4)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(CC)SC2=NC3=CC(=C(C=C3C(=O)N2CC4=CC=CO4)OC)OC

InChI

InChI=1S/C27H29N3O5S/c1-5-17-9-11-18(12-10-17)28-25(31)24(6-2)36-27-29-21-15-23(34-4)22(33-3)14-20(21)26(32)30(27)16-19-8-7-13-35-19/h7-15,24H,5-6,16H2,1-4H3,(H,28,31)