1-[2-(4-chlorophenyl)ethyl]-3-[[1-(phenylmethyl)pyrazol-4-yl]carbonylamino]thiourea

Systemtic Name: 1-[2-(4-chlorophenyl)ethyl]-3-[[1-(phenylmethyl)pyrazol-4-yl]carbonylamino]thiourea Openeye Name: 1-[(1-benzylpyrazole-4-carbonyl)amino]-3-[2-(4-chlorophenyl)ethyl]thiourea CAS Name: 1-[2-(4-chlorophenyl)ethyl]-3-[[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]thiourea IUPAC Name: 1-[(1-benzylpyrazole-4-carbonyl)amino]-3-[2-(4-chlorophenyl)ethyl]thiourea Traditional Name: 1-[(1-benzylpyrazole-4-carbonyl)amino]-3-[2-(4-chlorophenyl)ethyl]thiourea Formula: C20H20ClN5OS MolecularWeight: 413.9237

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)NNC(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)NNC(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN5OS/c21-18-8-6-15(7-9-18)10-11-22-20(28)25-24-19(27)17-12-23-26(14-17)13-16-4-2-1-3-5-16/h1-9,12,14H,10-11,13H2,(H,24,27)(H2,22,25,28)