N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[3-(3,4-dimethoxyphenyl)propyl]-4-keto-N-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

CN(CCCC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C24H27N3O4S/c1-5-12-27-23(29)18-10-9-17(15-19(18)25-24(27)32)22(28)26(2)13-6-7-16-8-11-20(30-3)21(14-16)31-4/h5,8-11,14-15H,1,6-7,12-13H2,2-4H3,(H,25,32)