1-[[4-(azepan-1-yl)phenyl]methyl]-3-(1-methylindazol-4-yl)urea

Systemtic Name: 1-[[4-(azepan-1-yl)phenyl]methyl]-3-(1-methylindazol-4-yl)urea Openeye Name: 1-[[4-(azepan-1-yl)phenyl]methyl]-3-(1-methylindazol-4-yl)urea CAS Name: 1-[[4-(1-azepanyl)phenyl]methyl]-3-(1-methyl-4-indazolyl)urea IUPAC Name: 1-[[4-(azepan-1-yl)phenyl]methyl]-3-(1-methylindazol-4-yl)urea Traditional Name: 1-[4-(azepan-1-yl)benzyl]-3-(1-methylindazol-4-yl)urea Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=CC=C2)NC(=O)NCC3=CC=C(C=C3)N4CCCCCC4

Isomeric SMILES

CN1C2=C(C=N1)C(=CC=C2)NC(=O)NCC3=CC=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C22H27N5O/c1-26-21-8-6-7-20(19(21)16-24-26)25-22(28)23-15-17-9-11-18(12-10-17)27-13-4-2-3-5-14-27/h6-12,16H,2-5,13-15H2,1H3,(H2,23,25,28)