4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-N'-(3,4,5-trimethoxyphenyl)carbonyl-1H-quinazoline-7-carbohydrazide

Systemtic Name: 4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-N'-(3,4,5-trimethoxyphenyl)carbonyl-1H-quinazoline-7-carbohydrazide Openeye Name: 3-allyl-4-oxo-2-thioxo-N'-(3,4,5-trimethoxybenzoyl)-1H-quinazoline-7-carbohydrazide CAS Name: 4-oxo-N'-[oxo-(3,4,5-trimethoxyphenyl)methyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide IUPAC Name: 4-oxo-3-prop-2-enyl-2-sulfanylidene-N'-(3,4,5-trimethoxybenzoyl)-1H-quinazoline-7-carbohydrazide Traditional Name: 3-allyl-4-keto-2-thioxo-N'-(3,4,5-trimethoxybenzoyl)-1H-quinazoline-7-carbohydrazide Formula: C22H22N4O6S MolecularWeight: 470.49828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C22H22N4O6S/c1-5-8-26-21(29)14-7-6-12(9-15(14)23-22(26)33)19(27)24-25-20(28)13-10-16(30-2)18(32-4)17(11-13)31-3/h5-7,9-11H,1,8H2,2-4H3,(H,23,33)(H,24,27)(H,25,28)