1-(2,3-dihydro-1H-inden-5-yl)-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yl)-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-indan-5-yl-3-[1-(o-tolylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-3-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-3-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-indan-5-yl-3-[1-(2-methylbenzyl)pyrazol-4-yl]thiourea Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)NC3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)NC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H22N4S/c1-15-5-2-3-6-18(15)13-25-14-20(12-22-25)24-21(26)23-19-10-9-16-7-4-8-17(16)11-19/h2-3,5-6,9-12,14H,4,7-8,13H2,1H3,(H2,23,24,26)