4-[4-(2-ethoxy-5-propan-2-yl-phenyl)sulfonylpiperazin-1-yl]-6-piperidin-1-yl-pyrimidine

Systemtic Name: 4-[4-(2-ethoxy-5-propan-2-yl-phenyl)sulfonylpiperazin-1-yl]-6-piperidin-1-yl-pyrimidine Openeye Name: 4-[4-(2-ethoxy-5-isopropyl-phenyl)sulfonylpiperazin-1-yl]-6-(1-piperidyl)pyrimidine CAS Name: 4-[4-(2-ethoxy-5-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-[4-(2-ethoxy-5-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-6-piperidin-1-ylpyrimidine Traditional Name: 4-[4-(2-ethoxy-5-isopropyl-phenyl)sulfonylpiperazino]-6-piperidino-pyrimidine Formula: C24H35N5O3S MolecularWeight: 473.6314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)C)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)C)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

InChI

InChI=1S/C24H35N5O3S/c1-4-32-21-9-8-20(19(2)3)16-22(21)33(30,31)29-14-12-28(13-15-29)24-17-23(25-18-26-24)27-10-6-5-7-11-27/h8-9,16-19H,4-7,10-15H2,1-3H3