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

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3-methyl-4-oxo-quinazolin-2-yl)propanamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3-methyl-4-oxo-2-quinazolinyl)propanamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3-methyl-4-oxoquinazolin-2-yl)propanamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(4-keto-3-methyl-quinazolin-2-yl)propionamide Formula: C26H22N4O2S MolecularWeight: 454.54348

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)NC3=CC=C(C=C3)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)NC3=CC=C(C=C3)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H22N4O2S/c1-30-23(28-20-7-3-2-6-19(20)26(30)32)14-15-24(31)27-18-12-10-17(11-13-18)16-25-29-21-8-4-5-9-22(21)33-25/h2-13H,14-16H2,1H3,(H,27,31)