1-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methyl]thiourea CAS Name: 1-[[3,5-dimethyl-1-(2-methylphenyl)-4-pyrazolyl]methyl]-3-prop-2-enylthiourea IUPAC Name: 1-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methyl]thiourea Formula: C17H22N4S MolecularWeight: 314.44838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C)CNC(=S)NCC=C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C)CNC(=S)NCC=C)C

InChI

InChI=1S/C17H22N4S/c1-5-10-18-17(22)19-11-15-13(3)20-21(14(15)4)16-9-7-6-8-12(16)2/h5-9H,1,10-11H2,2-4H3,(H2,18,19,22)