[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone Openeye Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(2-isopropyl-4-quinolyl)methanone CAS Name: [4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-(2-propan-2-yl-4-quinolinyl)methanone IUPAC Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone Traditional Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazino]-(2-isopropyl-4-quinolyl)methanone Formula: C25H26N4OS MolecularWeight: 430.56514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)N3CCN(CC3)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)N3CCN(CC3)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H26N4OS/c1-17(2)22-15-19(18-7-3-4-8-20(18)26-22)25(30)29-13-11-28(12-14-29)16-24-27-21-9-5-6-10-23(21)31-24/h3-10,15,17H,11-14,16H2,1-2H3