3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(8-methyl-4-oxo-quinazolin-3-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(8-methyl-4-oxo-3-quinazolinyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(8-methyl-4-oxoquinazolin-3-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-keto-8-methyl-quinazolin-3-yl)-N-(6-mesyl-1,3-benzothiazol-2-yl)propionamide Formula: C20H18N4O4S2 MolecularWeight: 442.51132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C20H18N4O4S2/c1-12-4-3-5-14-18(12)21-11-24(19(14)26)9-8-17(25)23-20-22-15-7-6-13(30(2,27)28)10-16(15)29-20/h3-7,10-11H,8-9H2,1-2H3,(H,22,23,25)