(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]methanone

Systemtic Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]methanone Openeye Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]methanone CAS Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]methanone IUPAC Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]methanone Traditional Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(4-methylpiperidino)sulfonylphenyl]methanone Formula: C23H28N2O3S2 MolecularWeight: 444.61002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(SC4=CC=CC=C43)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(SC4=CC=CC=C43)C

InChI

InChI=1S/C23H28N2O3S2/c1-17-11-14-24(15-12-17)30(27,28)20-9-7-19(8-10-20)23(26)25-16-13-18(2)29-22-6-4-3-5-21(22)25/h3-10,17-18H,11-16H2,1-2H3