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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5OS/c1-2-3-7-10-18-17(24)21-20-16(23)15-11-19-22(13-15)12-14-8-5-4-6-9-14/h4-6,8-9,11,13H,2-3,7,10,12H2,1H3,(H,20,23)(H2,18,21,24)