1-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]-3-propyl-urea

Systemtic Name: 1-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]-3-propyl-urea Openeye Name: 1-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]-3-propyl-urea CAS Name: 1-[1-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolyl]-3-propylurea IUPAC Name: 1-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]-3-propylurea Traditional Name: 1-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]-3-propyl-urea Formula: C23H25N7O MolecularWeight: 415.4909

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N7O/c1-3-12-25-23(31)28-18-9-10-20-19(14-18)26-15-30(20)21-11-13-24-22(29-21)27-16(2)17-7-5-4-6-8-17/h4-11,13-16H,3,12H2,1-2H3,(H,24,27,29)(H2,25,28,31)