5-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-8-methyl-quinoline

Systemtic Name: 5-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-8-methyl-quinoline Openeye Name: 5-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-8-methyl-quinoline CAS Name: 5-[[4-(3-methoxyphenyl)-1-piperazinyl]sulfonyl]-8-methylquinoline IUPAC Name: 5-[4-(3-methoxyphenyl)piperazin-1-yl]sulfonyl-8-methylquinoline Traditional Name: 5-[4-(3-methoxyphenyl)piperazino]sulfonyl-8-methyl-quinoline Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)OC)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)OC)C=CC=N2

InChI

InChI=1S/C21H23N3O3S/c1-16-8-9-20(19-7-4-10-22-21(16)19)28(25,26)24-13-11-23(12-14-24)17-5-3-6-18(15-17)27-2/h3-10,15H,11-14H2,1-2H3