3-(diethylamino)-N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]propanamide

Systemtic Name: 3-(diethylamino)-N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]propanamide Openeye Name: 3-(diethylamino)-N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]propanamide CAS Name: 3-(diethylamino)-N-[1-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolyl]propanamide IUPAC Name: 3-(diethylamino)-N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]propanamide Traditional Name: 3-(diethylamino)-N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]propionamide Formula: C26H31N7O MolecularWeight: 457.57064

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC(=O)NC1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NC(C)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)CCC(=O)NC1=CC2=C(C=C1)N(C=N2)C3=NC(=NC=C3)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C26H31N7O/c1-4-32(5-2)16-14-25(34)30-21-11-12-23-22(17-21)28-18-33(23)24-13-15-27-26(31-24)29-19(3)20-9-7-6-8-10-20/h6-13,15,17-19H,4-5,14,16H2,1-3H3,(H,30,34)(H,27,29,31)