N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(8-methyl-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(8-methyl-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(8-methyl-4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-4-(4-keto-8-methyl-quinazolin-3-yl)butyramide Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N4O2S/c1-15-6-4-7-16-21(15)24-14-26(22(16)28)13-5-10-19(27)23-12-11-20-25-17-8-2-3-9-18(17)29-20/h2-4,6-9,14H,5,10-13H2,1H3,(H,23,27)