2-[(2-methylphenyl)methylsulfanyl]-4-oxidanylidene-3-(oxolan-2-ylmethyl)-N-propan-2-yl-quinazoline-7-carboxamide

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-4-oxidanylidene-3-(oxolan-2-ylmethyl)-N-propan-2-yl-quinazoline-7-carboxamide Openeye Name: N-isopropyl-2-(o-tolylmethylsulfanyl)-4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazoline-7-carboxamide CAS Name: 2-[(2-methylphenyl)methylthio]-4-oxo-3-(2-oxolanylmethyl)-N-propan-2-yl-7-quinazolinecarboxamide IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-4-oxo-3-(oxolan-2-ylmethyl)-N-propan-2-ylquinazoline-7-carboxamide Traditional Name: N-isopropyl-4-keto-2-[(2-methylbenzyl)thio]-3-(tetrahydrofurfuryl)quinazoline-7-carboxamide Formula: C25H29N3O3S MolecularWeight: 451.58106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C=CC(=C3)C(=O)NC(C)C)C(=O)N2CC4CCCO4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C=CC(=C3)C(=O)NC(C)C)C(=O)N2CC4CCCO4

InChI

InChI=1S/C25H29N3O3S/c1-16(2)26-23(29)18-10-11-21-22(13-18)27-25(32-15-19-8-5-4-7-17(19)3)28(24(21)30)14-20-9-6-12-31-20/h4-5,7-8,10-11,13,16,20H,6,9,12,14-15H2,1-3H3,(H,26,29)