3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[3-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-4-methoxy-phenyl]methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[3-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-4-methoxy-phenyl]methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[3-[[(3R,5S)-3,5-dimethyl-1-piperidyl]sulfonyl]-4-methoxy-phenyl]methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[3-[[(3R,5S)-3,5-dimethyl-1-piperidinyl]sulfonyl]-4-methoxyphenyl]methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[3-[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl-4-methoxyphenyl]methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[3-[(3R,5S)-3,5-dimethylpiperidino]sulfonyl-4-methoxy-phenyl]methanone Formula: C24H30N2O4S2 MolecularWeight: 474.636

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCSC4=CC=CC=C43)OC)C

Isomeric SMILES

C[C@@H]1C[C@@H](CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCCSC4=CC=CC=C43)OC)C

InChI

InChI=1S/C24H30N2O4S2/c1-17-13-18(2)16-25(15-17)32(28,29)23-14-19(9-10-21(23)30-3)24(27)26-11-6-12-31-22-8-5-4-7-20(22)26/h4-5,7-10,14,17-18H,6,11-13,15-16H2,1-3H3/t17-,18+