5-tert-butyl-N-methyl-3-[[4-(pyridin-4-ylmethylamino)naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxamide

Systemtic Name: 5-tert-butyl-N-methyl-3-[[4-(pyridin-4-ylmethylamino)naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxamide Openeye Name: 5-tert-butyl-N-methyl-3-[[4-(4-pyridylmethylamino)-1-naphthyl]carbamoylamino]-1H-pyrrole-2-carboxamide CAS Name: 5-tert-butyl-N-methyl-3-[[oxo-[[4-(pyridin-4-ylmethylamino)-1-naphthalenyl]amino]methyl]amino]-1H-pyrrole-2-carboxamide IUPAC Name: 5-tert-butyl-N-methyl-3-[[4-(pyridin-4-ylmethylamino)naphthalen-1-yl]carbamoylamino]-1H-pyrrole-2-carboxamide Traditional Name: 5-tert-butyl-N-methyl-3-[[4-(4-pyridylmethylamino)-1-naphthyl]carbamoylamino]-1H-pyrrole-2-carboxamide Formula: C27H30N6O2 MolecularWeight: 470.5661

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(N1)C(=O)NC)NC(=O)NC2=CC=C(C3=CC=CC=C32)NCC4=CC=NC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=C(N1)C(=O)NC)NC(=O)NC2=CC=C(C3=CC=CC=C32)NCC4=CC=NC=C4

InChI

InChI=1S/C27H30N6O2/c1-27(2,3)23-15-22(24(33-23)25(34)28-4)32-26(35)31-21-10-9-20(18-7-5-6-8-19(18)21)30-16-17-11-13-29-14-12-17/h5-15,30,33H,16H2,1-4H3,(H,28,34)(H2,31,32,35)