5-[1-(aminocarbonylamino)-4-pyridin-3-yl-4-pyrrolidin-1-yl-butyl]-N-(2-aminophenyl)pyridine-2-carboxamide

Systemtic Name: 5-[1-(aminocarbonylamino)-4-pyridin-3-yl-4-pyrrolidin-1-yl-butyl]-N-(2-aminophenyl)pyridine-2-carboxamide Openeye Name: N-(2-aminophenyl)-5-[4-(3-pyridyl)-4-pyrrolidin-1-yl-1-ureido-butyl]pyridine-2-carboxamide CAS Name: N-(2-aminophenyl)-5-[1-(carbamoylamino)-4-(3-pyridinyl)-4-(1-pyrrolidinyl)butyl]-2-pyridinecarboxamide IUPAC Name: N-(2-aminophenyl)-5-[1-(carbamoylamino)-4-pyridin-3-yl-4-pyrrolidin-1-ylbutyl]pyridine-2-carboxamide Traditional Name: N-(2-aminophenyl)-5-[4-(3-pyridyl)-4-pyrrolidino-1-ureido-butyl]picolinamide Formula: C26H31N7O2 MolecularWeight: 473.57004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CCC(C2=CN=C(C=C2)C(=O)NC3=CC=CC=C3N)NC(=O)N)C4=CN=CC=C4

Isomeric SMILES

C1CCN(C1)C(CCC(C2=CN=C(C=C2)C(=O)NC3=CC=CC=C3N)NC(=O)N)C4=CN=CC=C4

InChI

InChI=1S/C26H31N7O2/c27-20-7-1-2-8-22(20)31-25(34)23-10-9-18(17-30-23)21(32-26(28)35)11-12-24(33-14-3-4-15-33)19-6-5-13-29-16-19/h1-2,5-10,13,16-17,21,24H,3-4,11-12,14-15,27H2,(H,31,34)(H3,28,32,35)