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

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(8-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(4-keto-8-methyl-quinazolin-3-yl)propionamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O2S/c1-14-5-4-6-15-20(14)23-13-25(21(15)27)12-10-18(26)22-11-9-19-24-16-7-2-3-8-17(16)28-19/h2-8,13H,9-12H2,1H3,(H,22,26)