1-[[4-(azepan-1-yl)-2-chloranyl-phenyl]methyl]-3-(1H-indazol-4-yl)urea

Systemtic Name: 1-[[4-(azepan-1-yl)-2-chloranyl-phenyl]methyl]-3-(1H-indazol-4-yl)urea Openeye Name: 1-[[4-(azepan-1-yl)-2-chloro-phenyl]methyl]-3-(1H-indazol-4-yl)urea CAS Name: 1-[[4-(1-azepanyl)-2-chlorophenyl]methyl]-3-(1H-indazol-4-yl)urea IUPAC Name: 1-[[4-(azepan-1-yl)-2-chlorophenyl]methyl]-3-(1H-indazol-4-yl)urea Traditional Name: 1-[4-(azepan-1-yl)-2-chloro-benzyl]-3-(1H-indazol-4-yl)urea Formula: C21H24ClN5O MolecularWeight: 397.90116

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=C(C=C2)CNC(=O)NC3=CC=CC4=C3C=NN4)Cl

Isomeric SMILES

C1CCCN(CC1)C2=CC(=C(C=C2)CNC(=O)NC3=CC=CC4=C3C=NN4)Cl

InChI

InChI=1S/C21H24ClN5O/c22-18-12-16(27-10-3-1-2-4-11-27)9-8-15(18)13-23-21(28)25-19-6-5-7-20-17(19)14-24-26-20/h5-9,12,14H,1-4,10-11,13H2,(H,24,26)(H2,23,25,28)