4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-2-[4-(2-pyrrol-1-ylethyl)piperazin-1-yl]pyrimidine

Systemtic Name: 4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-2-[4-(2-pyrrol-1-ylethyl)piperazin-1-yl]pyrimidine Openeye Name: 4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-2-[4-(2-pyrrol-1-ylethyl)piperazin-1-yl]pyrimidine CAS Name: 4-(1-ethyl-3,5-dimethyl-4-pyrazolyl)-2-[4-[2-(1-pyrrolyl)ethyl]-1-piperazinyl]pyrimidine IUPAC Name: 4-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[4-(2-pyrrol-1-ylethyl)piperazin-1-yl]pyrimidine Traditional Name: 4-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-2-[4-(2-pyrrol-1-ylethyl)piperazino]pyrimidine Formula: C21H29N7 MolecularWeight: 379.50186

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C2=NC(=NC=C2)N3CCN(CC3)CCN4C=CC=C4)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)C2=NC(=NC=C2)N3CCN(CC3)CCN4C=CC=C4)C

InChI

InChI=1S/C21H29N7/c1-4-28-18(3)20(17(2)24-28)19-7-8-22-21(23-19)27-15-13-26(14-16-27)12-11-25-9-5-6-10-25/h5-10H,4,11-16H2,1-3H3