8-[4-(cyclohexylmethyl)piperazin-1-yl]sulfonyl-3-methyl-quinoline

Systemtic Name: 8-[4-(cyclohexylmethyl)piperazin-1-yl]sulfonyl-3-methyl-quinoline Openeye Name: 8-[4-(cyclohexylmethyl)piperazin-1-yl]sulfonyl-3-methyl-quinoline CAS Name: 8-[[4-(cyclohexylmethyl)-1-piperazinyl]sulfonyl]-3-methylquinoline IUPAC Name: 8-[4-(cyclohexylmethyl)piperazin-1-yl]sulfonyl-3-methylquinoline Traditional Name: 8-[4-(cyclohexylmethyl)piperazino]sulfonyl-3-methyl-quinoline Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4CCCCC4

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)CC4CCCCC4

InChI

InChI=1S/C21H29N3O2S/c1-17-14-19-8-5-9-20(21(19)22-15-17)27(25,26)24-12-10-23(11-13-24)16-18-6-3-2-4-7-18/h5,8-9,14-15,18H,2-4,6-7,10-13,16H2,1H3