1-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-propan-2-yl-thiourea Openeye Name: 1-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]-3-isopropyl-thiourea CAS Name: 1-[[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)amino]-3-propan-2-ylthiourea Traditional Name: 1-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]-3-isopropyl-thiourea Formula: C16H20ClN5OS MolecularWeight: 365.8809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NNC(=S)NC(C)C)Cl)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)NNC(=S)NC(C)C)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C16H20ClN5OS/c1-10(2)18-16(24)20-19-15(23)13-11(3)21-22(14(13)17)9-12-7-5-4-6-8-12/h4-8,10H,9H2,1-3H3,(H,19,23)(H2,18,20,24)