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

Systemtic Name: 1-(3-methylbutyl)-3-[[1-(phenylmethyl)pyrazol-4-yl]carbonylamino]thiourea Openeye Name: 1-[(1-benzylpyrazole-4-carbonyl)amino]-3-isopentyl-thiourea CAS Name: 1-(3-methylbutyl)-3-[[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]thiourea IUPAC Name: 1-[(1-benzylpyrazole-4-carbonyl)amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[(1-benzylpyrazole-4-carbonyl)amino]-3-isoamyl-thiourea Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1=CN(N=C1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1=CN(N=C1)CC2=CC=CC=C2

InChI

InChI=1S/C17H23N5OS/c1-13(2)8-9-18-17(24)21-20-16(23)15-10-19-22(12-15)11-14-6-4-3-5-7-14/h3-7,10,12-13H,8-9,11H2,1-2H3,(H,20,23)(H2,18,21,24)