1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-methyl-but-2-en-1-one

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-methyl-but-2-en-1-one Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-methyl-but-2-en-1-one CAS Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-methyl-2-buten-1-one IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-methylbut-2-en-1-one Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)piperidino]-3-methyl-but-2-en-1-one Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCC(CC1)C2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC(=CC(=O)N1CCC(CC1)C2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C17H20N2OS/c1-12(2)11-16(20)19-9-7-13(8-10-19)17-18-14-5-3-4-6-15(14)21-17/h3-6,11,13H,7-10H2,1-2H3