N-[4-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]butanamide

Systemtic Name: N-[4-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]butanamide Openeye Name: N-[4-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]butanamide CAS Name: N-[4-[[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]sulfonyl]phenyl]butanamide IUPAC Name: N-[4-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]butanamide Traditional Name: N-[4-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]sulfonylphenyl]butyramide Formula: C22H30N6O3S MolecularWeight: 458.577

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCC4

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCC4

InChI

InChI=1S/C22H30N6O3S/c1-2-5-22(29)25-18-6-8-19(9-7-18)32(30,31)28-14-12-27(13-15-28)21-16-20(23-17-24-21)26-10-3-4-11-26/h6-9,16-17H,2-5,10-15H2,1H3,(H,25,29)