3-cyclopropyl-1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-thiourea

Systemtic Name: 3-cyclopropyl-1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-thiourea Openeye Name: 3-cyclopropyl-1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-thiourea CAS Name: 3-cyclopropyl-1-[(1,3-diphenyl-4-pyrazolyl)methyl]-1-methylthiourea IUPAC Name: 3-cyclopropyl-1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methylthiourea Traditional Name: 3-cyclopropyl-1-[(1,3-diphenylpyrazol-4-yl)methyl]-1-methyl-thiourea Formula: C21H22N4S MolecularWeight: 362.49118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NC4CC4

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=S)NC4CC4

InChI

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