2-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(6-fluoranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-(6-fluoro-4-oxo-quinazolin-3-yl)acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(6-fluoro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-(6-fluoro-4-oxoquinazolin-3-yl)acetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-(6-fluoro-4-keto-quinazolin-3-yl)acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H19FN4O3S MolecularWeight: 414.453263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C20H19FN4O3S/c1-10-2-4-12-15(6-10)29-19(17(12)18(22)27)24-16(26)8-25-9-23-14-5-3-11(21)7-13(14)20(25)28/h3,5,7,9-10H,2,4,6,8H2,1H3,(H2,22,27)(H,24,26)