4-(cyclopentylamino)-2-(3-imidazol-1-ylpropylamino)-N-phenethyl-pyrimidine-5-carboxamide

Systemtic Name: 4-(cyclopentylamino)-2-(3-imidazol-1-ylpropylamino)-N-phenethyl-pyrimidine-5-carboxamide Openeye Name: 4-(cyclopentylamino)-2-(3-imidazol-1-ylpropylamino)-N-phenethyl-pyrimidine-5-carboxamide CAS Name: 4-(cyclopentylamino)-2-[3-(1-imidazolyl)propylamino]-N-phenethyl-5-pyrimidinecarboxamide IUPAC Name: 4-(cyclopentylamino)-2-(3-imidazol-1-ylpropylamino)-N-phenethylpyrimidine-5-carboxamide Traditional Name: 4-(cyclopentylamino)-2-(3-imidazol-1-ylpropylamino)-N-phenethyl-pyrimidine-5-carboxamide Formula: C24H31N7O MolecularWeight: 433.54924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC(=NC=C2C(=O)NCCC3=CC=CC=C3)NCCCN4C=CN=C4

Isomeric SMILES

C1CCC(C1)NC2=NC(=NC=C2C(=O)NCCC3=CC=CC=C3)NCCCN4C=CN=C4

InChI

InChI=1S/C24H31N7O/c32-23(26-13-11-19-7-2-1-3-8-19)21-17-28-24(27-12-6-15-31-16-14-25-18-31)30-22(21)29-20-9-4-5-10-20/h1-3,7-8,14,16-18,20H,4-6,9-13,15H2,(H,26,32)(H2,27,28,29,30)