1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-3-prop-2-enyl-thiourea Openeye Name: 3-allyl-1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-thiourea CAS Name: 1-[(1,3-diphenyl-4-pyrazolyl)methyl]-1-methyl-3-prop-2-enylthiourea IUPAC Name: 1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-3-prop-2-enylthiourea Traditional Name: 3-allyl-1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-thiourea Formula: C21H22N4S MolecularWeight: 362.49118

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NCC=C

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NCC=C

InChI

InChI=1S/C21H22N4S/c1-3-14-22-21(26)24(2)15-18-16-25(19-12-8-5-9-13-19)23-20(18)17-10-6-4-7-11-17/h3-13,16H,1,14-15H2,2H3,(H,22,26)