N-(4-butylphenyl)-N-[2-[4-(3-cyanopyrazin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide

Systemtic Name: N-(4-butylphenyl)-N-[2-[4-(3-cyanopyrazin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide Openeye Name: N-(4-butylphenyl)-N-[2-[4-(3-cyanopyrazin-2-yl)piperazin-1-yl]-2-oxo-ethyl]methanesulfonamide CAS Name: N-(4-butylphenyl)-N-[2-[4-(3-cyano-2-pyrazinyl)-1-piperazinyl]-2-oxoethyl]methanesulfonamide IUPAC Name: N-(4-butylphenyl)-N-[2-[4-(3-cyanopyrazin-2-yl)piperazin-1-yl]-2-oxoethyl]methanesulfonamide Traditional Name: N-(4-butylphenyl)-N-[2-[4-(3-cyanopyrazin-2-yl)piperazino]-2-keto-ethyl]methanesulfonamide Formula: C22H28N6O3S MolecularWeight: 456.56112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C3=NC=CN=C3C#N)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N(CC(=O)N2CCN(CC2)C3=NC=CN=C3C#N)S(=O)(=O)C

InChI

InChI=1S/C22H28N6O3S/c1-3-4-5-18-6-8-19(9-7-18)28(32(2,30)31)17-21(29)26-12-14-27(15-13-26)22-20(16-23)24-10-11-25-22/h6-11H,3-5,12-15,17H2,1-2H3