N-[4-[2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[2-(2-methyl-4-oxo-quinazolin-3-yl)acetyl]amino]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[2-(2-methyl-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[2-(2-methyl-4-oxoquinazolin-3-yl)acetyl]amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[2-(4-keto-2-methyl-quinazolin-3-yl)acetyl]amino]phenyl]thiophene-2-carboxamide Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H18N4O3S/c1-14-23-18-6-3-2-5-17(18)22(29)26(14)13-20(27)24-15-8-10-16(11-9-15)25-21(28)19-7-4-12-30-19/h2-12H,13H2,1H3,(H,24,27)(H,25,28)