N-(1,3-benzothiazol-2-ylmethyl)-3-ethyl-N-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-3-ethyl-N-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-3-ethyl-N-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-3-ethyl-N-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-3-ethyl-N-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-3-ethyl-4-keto-N-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H18N4O2S2 MolecularWeight: 410.51252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=NC4=CC=CC=C4S3)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=NC4=CC=CC=C4S3)NC1=S

InChI

InChI=1S/C20H18N4O2S2/c1-3-24-19(26)13-9-8-12(10-15(13)22-20(24)27)18(25)23(2)11-17-21-14-6-4-5-7-16(14)28-17/h4-10H,3,11H2,1-2H3,(H,22,27)