N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(2-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(2-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(2-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(4-keto-2-methyl-quinazolin-3-yl)propionamide Formula: C23H25N5O2S MolecularWeight: 435.5419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCC(=O)NC(CCSC)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H25N5O2S/c1-15-24-17-8-4-3-7-16(17)23(30)28(15)13-11-21(29)25-20(12-14-31-2)22-26-18-9-5-6-10-19(18)27-22/h3-10,20H,11-14H2,1-2H3,(H,25,29)(H,26,27)