4-methoxy-N-[4-oxidanylidene-2-(thiophen-2-ylmethyl)quinazolin-3-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-methoxy-N-[4-oxidanylidene-2-(thiophen-2-ylmethyl)quinazolin-3-yl]cyclohexane-1-carboxamide Openeye Name: 4-methoxy-N-[4-oxo-2-(2-thienylmethyl)quinazolin-3-yl]cyclohexanecarboxamide CAS Name: 4-methoxy-N-[4-oxo-2-(thiophen-2-ylmethyl)-3-quinazolinyl]-1-cyclohexanecarboxamide IUPAC Name: 4-methoxy-N-[4-oxo-2-(thiophen-2-ylmethyl)quinazolin-3-yl]cyclohexane-1-carboxamide Traditional Name: N-[4-keto-2-(2-thenyl)quinazolin-3-yl]-4-methoxy-cyclohexanecarboxamide Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(CC1)C(=O)NN2C(=NC3=CC=CC=C3C2=O)CC4=CC=CS4

Isomeric SMILES

COC1CCC(CC1)C(=O)NN2C(=NC3=CC=CC=C3C2=O)CC4=CC=CS4

InChI

InChI=1S/C21H23N3O3S/c1-27-15-10-8-14(9-11-15)20(25)23-24-19(13-16-5-4-12-28-16)22-18-7-3-2-6-17(18)21(24)26/h2-7,12,14-15H,8-11,13H2,1H3,(H,23,25)