1-(azepan-1-yl)-2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propan-1-one Openeye Name: 1-(azepan-1-yl)-2-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]propan-1-one CAS Name: 1-(1-azepanyl)-2-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]propan-1-one Traditional Name: 1-(azepan-1-yl)-2-[4-(1,3-benzothiazol-2-yl)piperidino]propan-1-one Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)N1CCCCCC1)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H29N3OS/c1-16(21(25)24-12-6-2-3-7-13-24)23-14-10-17(11-15-23)20-22-18-8-4-5-9-19(18)26-20/h4-5,8-9,16-17H,2-3,6-7,10-15H2,1H3