N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-(8-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)ethyl]-3-(4-keto-8-methyl-quinazolin-3-yl)propionamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC(C)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)N[C@@H](C)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H21N5O2/c1-13-6-5-7-15-19(13)22-12-26(21(15)28)11-10-18(27)23-14(2)20-24-16-8-3-4-9-17(16)25-20/h3-9,12,14H,10-11H2,1-2H3,(H,23,27)(H,24,25)/t14-/m0/s1