N-(4-butylphenyl)-2-methyl-5-(4-pyrazin-2-ylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-(4-butylphenyl)-2-methyl-5-(4-pyrazin-2-ylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(4-butylphenyl)-2-methyl-5-(4-pyrazin-2-ylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-(4-butylphenyl)-2-methyl-5-[oxo-[4-(2-pyrazinyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N-(4-butylphenyl)-2-methyl-5-(4-pyrazin-2-ylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: N-(4-butylphenyl)-2-methyl-5-(4-pyrazin-2-ylpiperazine-1-carbonyl)benzenesulfonamide Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C4=NC=CN=C4)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C4=NC=CN=C4)C

InChI

InChI=1S/C26H31N5O3S/c1-3-4-5-21-7-10-23(11-8-21)29-35(33,34)24-18-22(9-6-20(24)2)26(32)31-16-14-30(15-17-31)25-19-27-12-13-28-25/h6-13,18-19,29H,3-5,14-17H2,1-2H3