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

Systemtic Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-(8-methyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-(8-methyl-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-(8-methyl-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide Traditional Name: 3-(4-keto-8-methyl-quinazolin-3-yl)-N-(4-methoxy-1,3-benzothiazol-2-yl)propionamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=NC4=C(C=CC=C4S3)OC

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)NC3=NC4=C(C=CC=C4S3)OC

InChI

InChI=1S/C20H18N4O3S/c1-12-5-3-6-13-17(12)21-11-24(19(13)26)10-9-16(25)22-20-23-18-14(27-2)7-4-8-15(18)28-20/h3-8,11H,9-10H2,1-2H3,(H,22,23,25)