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

Systemtic Name: [1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Openeye Name: [1-(4-chlorophenyl)sulfonyl-4-piperidyl]-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone CAS Name: [1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone IUPAC Name: [1-(4-chlorophenyl)sulfonylpiperidin-4-yl]-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Traditional Name: [1-(4-chlorophenyl)sulfonyl-4-piperidyl]-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Formula: C21H23ClN2O3S2 MolecularWeight: 451.00192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN2O3S2/c22-17-6-8-18(9-7-17)29(26,27)23-13-10-16(11-14-23)21(25)24-12-3-15-28-20-5-2-1-4-19(20)24/h1-2,4-9,16H,3,10-15H2