[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-dimethylaminophenyl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-dimethylaminophenyl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-dimethylaminophenyl)methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(4-dimethylaminophenyl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(4-dimethylaminophenyl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-(4-dimethylaminophenyl)methanone Formula: C19H30N4O3S MolecularWeight: 394.5315

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H30N4O3S/c1-20(2)18-9-7-17(8-10-18)19(24)21-13-15-23(16-14-21)27(25,26)22-11-5-3-4-6-12-22/h7-10H,3-6,11-16H2,1-2H3