3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCSC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCSC4=CC=CC=C43)C

InChI

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