1-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-3-(3-methoxypropyl)-1-methyl-thiourea

Systemtic Name: 1-[(1,3-diphenylpyrazol-4-yl)carbonylamino]-3-(3-methoxypropyl)-1-methyl-thiourea Openeye Name: 1-[(1,3-diphenylpyrazole-4-carbonyl)amino]-3-(3-methoxypropyl)-1-methyl-thiourea CAS Name: 1-[[(1,3-diphenyl-4-pyrazolyl)-oxomethyl]amino]-3-(3-methoxypropyl)-1-methylthiourea IUPAC Name: 1-[(1,3-diphenylpyrazole-4-carbonyl)amino]-3-(3-methoxypropyl)-1-methylthiourea Traditional Name: 1-[(1,3-diphenylpyrazole-4-carbonyl)amino]-3-(3-methoxypropyl)-1-methyl-thiourea Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)C1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)C1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H25N5O2S/c1-26(22(30)23-14-9-15-29-2)25-21(28)19-16-27(18-12-7-4-8-13-18)24-20(19)17-10-5-3-6-11-17/h3-8,10-13,16H,9,14-15H2,1-2H3,(H,23,30)(H,25,28)