N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(2-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(2-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(2-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-keto-2-methyl-quinazolin-3-yl)propionamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CCN3C(=NC4=CC=CC=C4C3=O)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CCN3C(=NC4=CC=CC=C4C3=O)C)C

InChI

InChI=1S/C21H20N4O2S/c1-12-10-13(2)19-17(11-12)28-21(24-19)23-18(26)8-9-25-14(3)22-16-7-5-4-6-15(16)20(25)27/h4-7,10-11H,8-9H2,1-3H3,(H,23,24,26)