1-[5-azanyl-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea

Systemtic Name: 1-[5-azanyl-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea Openeye Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea CAS Name: 1-[5-amino-3-(4-chlorophenyl)-1-(phenylmethyl)-4-pyrazolyl]-3-(2-dimethylaminoethyl)urea IUPAC Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea Traditional Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(2-dimethylaminoethyl)urea Formula: C21H25ClN6O MolecularWeight: 412.9158

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)NC1=C(N(N=C1C2=CC=C(C=C2)Cl)CC3=CC=CC=C3)N

Isomeric SMILES

CN(C)CCNC(=O)NC1=C(N(N=C1C2=CC=C(C=C2)Cl)CC3=CC=CC=C3)N

InChI

InChI=1S/C21H25ClN6O/c1-27(2)13-12-24-21(29)25-19-18(16-8-10-17(22)11-9-16)26-28(20(19)23)14-15-6-4-3-5-7-15/h3-11H,12-14,23H2,1-2H3,(H2,24,25,29)