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

Systemtic Name: 1-[5-azanyl-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazol-4-yl]-3-(cyclopropylmethyl)urea Openeye Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(cyclopropylmethyl)urea CAS Name: 1-[5-amino-3-(4-chlorophenyl)-1-(phenylmethyl)-4-pyrazolyl]-3-(cyclopropylmethyl)urea IUPAC Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(cyclopropylmethyl)urea Traditional Name: 1-[5-amino-1-benzyl-3-(4-chlorophenyl)pyrazol-4-yl]-3-(cyclopropylmethyl)urea Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)NC2=C(N(N=C2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4)N

Isomeric SMILES

C1CC1CNC(=O)NC2=C(N(N=C2C3=CC=C(C=C3)Cl)CC4=CC=CC=C4)N

InChI

InChI=1S/C21H22ClN5O/c22-17-10-8-16(9-11-17)18-19(25-21(28)24-12-14-6-7-14)20(23)27(26-18)13-15-4-2-1-3-5-15/h1-5,8-11,14H,6-7,12-13,23H2,(H2,24,25,28)