N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]pentanamide Openeye Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]pentanamide CAS Name: N-[[4-[(6,7-dimethoxy-4-quinazolinyl)oxy]anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]carbamothioyl]pentanamide Traditional Name: N-[[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]thiocarbamoyl]valeramide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)OC2=NC=NC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C22H24N4O4S/c1-4-5-6-20(27)26-22(31)25-14-7-9-15(10-8-14)30-21-16-11-18(28-2)19(29-3)12-17(16)23-13-24-21/h7-13H,4-6H2,1-3H3,(H2,25,26,27,31)