2-(2-cyclopropylquinazolin-4-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(2-cyclopropyl-4-quinazolinyl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(2-cyclopropylquinazolin-4-yl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C21H18N4O2S2/c1-27-13-8-9-16-17(10-13)29-21(23-16)24-18(26)11-28-20-14-4-2-3-5-15(14)22-19(25-20)12-6-7-12/h2-5,8-10,12H,6-7,11H2,1H3,(H,23,24,26)