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

Systemtic Name: 1-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-cyclopentyl-thiourea Openeye Name: 1-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]-3-cyclopentyl-thiourea CAS Name: 1-[[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]-3-cyclopentylthiourea IUPAC Name: 1-[(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)amino]-3-cyclopentylthiourea Traditional Name: 1-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]-3-cyclopentyl-thiourea Formula: C18H22ClN5OS MolecularWeight: 391.91818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NNC(=S)NC2CCCC2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NNC(=S)NC2CCCC2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C18H22ClN5OS/c1-12-15(16(19)24(23-12)11-13-7-3-2-4-8-13)17(25)21-22-18(26)20-14-9-5-6-10-14/h2-4,7-8,14H,5-6,9-11H2,1H3,(H,21,25)(H2,20,22,26)