3-methyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide

Systemtic Name: 3-methyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide Openeye Name: 3-methyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide CAS Name: 3-methyl-N-[4-[[4-(2-pyrazinyl)-1-piperazinyl]sulfonyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-(4-pyrazin-2-ylpiperazin-1-yl)sulfonylphenyl]butanamide Traditional Name: 3-methyl-N-[4-(4-pyrazin-2-ylpiperazino)sulfonylphenyl]butyramide Formula: C19H25N5O3S MolecularWeight: 403.4985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CN=C3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=CN=C3

InChI

InChI=1S/C19H25N5O3S/c1-15(2)13-19(25)22-16-3-5-17(6-4-16)28(26,27)24-11-9-23(10-12-24)18-14-20-7-8-21-18/h3-8,14-15H,9-13H2,1-2H3,(H,22,25)