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

Systemtic Name: 1-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]-3-isopentyl-thiourea CAS Name: 1-[[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]-3-isoamyl-thiourea Formula: C18H24ClN5OS MolecularWeight: 393.93406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24ClN5OS/c1-12(2)9-10-20-18(26)22-21-17(25)15-13(3)23-24(16(15)19)11-14-7-5-4-6-8-14/h4-8,12H,9-11H2,1-3H3,(H,21,25)(H2,20,22,26)