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

Systemtic Name: [1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Openeye Name: [1-(4-ethoxyphenyl)sulfonyl-4-piperidyl]-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone CAS Name: [1-(4-ethoxyphenyl)sulfonyl-4-piperidinyl]-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone IUPAC Name: [1-(4-ethoxyphenyl)sulfonylpiperidin-4-yl]-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Traditional Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-(1-p-phenetylsulfonyl-4-piperidyl)methanone Formula: C24H30N2O4S2 MolecularWeight: 474.636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(SC4=CC=CC=C43)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(SC4=CC=CC=C43)C

InChI

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