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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(SC4=CC=CC=C43)C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCC(SC4=CC=CC=C43)C

InChI

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