1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-propyl-thiourea

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-propyl-thiourea Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-propyl-thiourea CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-propylthiourea IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-propylthiourea Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-propyl-thiourea Formula: C16H22N4S MolecularWeight: 302.43768

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NCC1=C(N(N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CCCNC(=S)NCC1=C(N(N=C1C)C2=CC=CC=C2)C

InChI

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