N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C)OC4CCCC4

InChI

InChI=1S/C24H25N3O4S/c1-3-12-27-23(29)18-10-8-15(13-19(18)26-24(27)32)22(28)25-16-9-11-20(30-2)21(14-16)31-17-6-4-5-7-17/h3,8-11,13-14,17H,1,4-7,12H2,2H3,(H,25,28)(H,26,32)