1-cyclopentyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-cyclopentyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-cyclopentyl-3-[1-(o-tolylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-cyclopentyl-3-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-cyclopentyl-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-cyclopentyl-3-[1-(2-methylbenzyl)pyrazol-4-yl]thiourea Formula: C17H22N4S MolecularWeight: 314.44838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)NC3CCCC3

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)NC3CCCC3

InChI

InChI=1S/C17H22N4S/c1-13-6-2-3-7-14(13)11-21-12-16(10-18-21)20-17(22)19-15-8-4-5-9-15/h2-3,6-7,10,12,15H,4-5,8-9,11H2,1H3,(H2,19,20,22)