1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidyl]-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-2-[(2-cyclopropyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-(2-cyclopropylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)piperidino]-2-[(2-cyclopropylquinazolin-4-yl)thio]ethanone Formula: C25H24N4OS2 MolecularWeight: 460.61426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4CC4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4CC4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C25H24N4OS2/c30-22(15-31-25-18-7-1-2-8-19(18)26-23(28-25)16-11-12-16)29-13-5-6-17(14-29)24-27-20-9-3-4-10-21(20)32-24/h1-4,7-10,16-17H,5-6,11-15H2