1-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-ethyl-thiourea

Systemtic Name: 1-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-3-ethyl-thiourea Openeye Name: 1-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-ethyl-thiourea CAS Name: 1-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-3-ethylthiourea IUPAC Name: 1-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-3-ethylthiourea Traditional Name: 1-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-ethyl-thiourea Formula: C16H22N4S MolecularWeight: 302.43768

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC1=C(N(N=C1C)CC2=CC=CC=C2)C

Isomeric SMILES

CCNC(=S)NCC1=C(N(N=C1C)CC2=CC=CC=C2)C

InChI

InChI=1S/C16H22N4S/c1-4-17-16(21)18-10-15-12(2)19-20(13(15)3)11-14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3,(H2,17,18,21)