N-phenethyl-4-phenylazanyl-2-(3-pyrrolidin-1-ylpropylamino)pyrimidine-5-carboxamide

Systemtic Name: N-phenethyl-4-phenylazanyl-2-(3-pyrrolidin-1-ylpropylamino)pyrimidine-5-carboxamide Openeye Name: 4-anilino-N-phenethyl-2-(3-pyrrolidin-1-ylpropylamino)pyrimidine-5-carboxamide CAS Name: 4-anilino-N-phenethyl-2-[3-(1-pyrrolidinyl)propylamino]-5-pyrimidinecarboxamide IUPAC Name: 4-anilino-N-phenethyl-2-(3-pyrrolidin-1-ylpropylamino)pyrimidine-5-carboxamide Traditional Name: 4-anilino-N-phenethyl-2-(3-pyrrolidinopropylamino)pyrimidine-5-carboxamide Formula: C26H32N6O MolecularWeight: 444.57188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC2=NC=C(C(=N2)NC3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CCCNC2=NC=C(C(=N2)NC3=CC=CC=C3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H32N6O/c33-25(27-16-14-21-10-3-1-4-11-21)23-20-29-26(28-15-9-19-32-17-7-8-18-32)31-24(23)30-22-12-5-2-6-13-22/h1-6,10-13,20H,7-9,14-19H2,(H,27,33)(H2,28,29,30,31)