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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N5OS/c1-17(2)13-14-24-23(30)26-25-22(29)20-16-28(15-18-9-5-3-6-10-18)27-21(20)19-11-7-4-8-12-19/h3-12,16-17H,13-15H2,1-2H3,(H,25,29)(H2,24,26,30)