1-pentyl-3-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]thiourea

Systemtic Name: 1-pentyl-3-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]thiourea Openeye Name: 1-[(1-benzyl-3-phenyl-pyrazole-4-carbonyl)amino]-3-pentyl-thiourea CAS Name: 1-[[oxo-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methyl]amino]-3-pentylthiourea IUPAC Name: 1-[(1-benzyl-3-phenylpyrazole-4-carbonyl)amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[(1-benzyl-3-phenyl-pyrazole-4-carbonyl)amino]thiourea Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H27N5OS/c1-2-3-10-15-24-23(30)26-25-22(29)20-17-28(16-18-11-6-4-7-12-18)27-21(20)19-13-8-5-9-14-19/h4-9,11-14,17H,2-3,10,15-16H2,1H3,(H,25,29)(H2,24,26,30)