N-(2-cyclopentylsulfanylphenyl)-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-(2-cyclopentylsulfanylphenyl)-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[2-(cyclopentylthio)phenyl]-3-(8-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(2-cyclopentylsulfanylphenyl)-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[2-(cyclopentylthio)phenyl]-3-(4-keto-8-methyl-quinazolin-3-yl)propionamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=CC=CC=C3SC4CCCC4

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=CC=CC=C3SC4CCCC4

InChI

InChI=1S/C23H25N3O2S/c1-16-7-6-10-18-22(16)24-15-26(23(18)28)14-13-21(27)25-19-11-4-5-12-20(19)29-17-8-2-3-9-17/h4-7,10-12,15,17H,2-3,8-9,13-14H2,1H3,(H,25,27)