[3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-(4-piperidin-1-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: [3-(azepan-1-ylsulfonyl)-4-chloranyl-phenyl]-(4-piperidin-1-ylcarbonylpiperazin-1-yl)methanone Openeye Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-[4-(piperidine-1-carbonyl)piperazin-1-yl]methanone CAS Name: [3-(1-azepanylsulfonyl)-4-chlorophenyl]-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]methanone IUPAC Name: [3-(azepan-1-ylsulfonyl)-4-chlorophenyl]-[4-(piperidine-1-carbonyl)piperazin-1-yl]methanone Traditional Name: [3-(azepan-1-ylsulfonyl)-4-chloro-phenyl]-[4-(piperidine-1-carbonyl)piperazino]methanone Formula: C23H33ClN4O4S MolecularWeight: 497.05052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C(=O)N4CCCCC4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C(=O)N4CCCCC4)Cl

InChI

InChI=1S/C23H33ClN4O4S/c24-20-9-8-19(18-21(20)33(31,32)28-12-6-1-2-7-13-28)22(29)25-14-16-27(17-15-25)23(30)26-10-4-3-5-11-26/h8-9,18H,1-7,10-17H2