N-cyclopropyl-4-(4-ethylpiperazin-1-yl)-2-(4-methoxyphenyl)pyrimidine-5-carboxamide

Systemtic Name: N-cyclopropyl-4-(4-ethylpiperazin-1-yl)-2-(4-methoxyphenyl)pyrimidine-5-carboxamide Openeye Name: N-cyclopropyl-4-(4-ethylpiperazin-1-yl)-2-(4-methoxyphenyl)pyrimidine-5-carboxamide CAS Name: N-cyclopropyl-4-(4-ethyl-1-piperazinyl)-2-(4-methoxyphenyl)-5-pyrimidinecarboxamide IUPAC Name: N-cyclopropyl-4-(4-ethylpiperazin-1-yl)-2-(4-methoxyphenyl)pyrimidine-5-carboxamide Traditional Name: N-cyclopropyl-4-(4-ethylpiperazino)-2-(4-methoxyphenyl)pyrimidine-5-carboxamide Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=NC=C2C(=O)NC3CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=NC=C2C(=O)NC3CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H27N5O2/c1-3-25-10-12-26(13-11-25)20-18(21(27)23-16-6-7-16)14-22-19(24-20)15-4-8-17(28-2)9-5-15/h4-5,8-9,14,16H,3,6-7,10-13H2,1-2H3,(H,23,27)