[5-(azepan-1-ylsulfonyl)-2-methyl-phenyl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [5-(azepan-1-ylsulfonyl)-2-methyl-phenyl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [5-(azepan-1-ylsulfonyl)-2-methyl-phenyl]-(4-methylpiperazin-1-yl)methanone CAS Name: [5-(1-azepanylsulfonyl)-2-methylphenyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [5-(azepan-1-ylsulfonyl)-2-methylphenyl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [5-(azepan-1-ylsulfonyl)-2-methyl-phenyl]-(4-methylpiperazino)methanone Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)N3CCN(CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)N3CCN(CC3)C

InChI

InChI=1S/C19H29N3O3S/c1-16-7-8-17(26(24,25)22-9-5-3-4-6-10-22)15-18(16)19(23)21-13-11-20(2)12-14-21/h7-8,15H,3-6,9-14H2,1-2H3