1-(3-piperidin-1-yl-2,3,4,5-tetrahydro-1,4-benzothiazepin-2-yl)ethanone

Systemtic Name: 1-(3-piperidin-1-yl-2,3,4,5-tetrahydro-1,4-benzothiazepin-2-yl)ethanone Openeye Name: 1-[3-(1-piperidyl)-2,3,4,5-tetrahydro-1,4-benzothiazepin-2-yl]ethanone CAS Name: 1-[3-(1-piperidinyl)-2,3,4,5-tetrahydro-1,4-benzothiazepin-2-yl]ethanone IUPAC Name: 1-(3-piperidin-1-yl-2,3,4,5-tetrahydro-1,4-benzothiazepin-2-yl)ethanone Traditional Name: 1-(3-piperidino-2,3,4,5-tetrahydro-1,4-benzothiazepin-2-yl)ethanone Formula: C16H22N2OS MolecularWeight: 290.42368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(NCC2=CC=CC=C2S1)N3CCCCC3

Isomeric SMILES

CC(=O)C1C(NCC2=CC=CC=C2S1)N3CCCCC3

InChI

InChI=1S/C16H22N2OS/c1-12(19)15-16(18-9-5-2-6-10-18)17-11-13-7-3-4-8-14(13)20-15/h3-4,7-8,15-17H,2,5-6,9-11H2,1H3