1-(1,3-benzodioxol-5-yl)-3-[1-(phenylmethyl)pyrazol-3-yl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(phenylmethyl)pyrazol-3-yl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(1-benzylpyrazol-3-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(phenylmethyl)-3-pyrazolyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(1-benzylpyrazol-3-yl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(1-benzylpyrazol-3-yl)thiourea Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=NN(C=C3)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=NN(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C18H16N4O2S/c25-18(19-14-6-7-15-16(10-14)24-12-23-15)20-17-8-9-22(21-17)11-13-4-2-1-3-5-13/h1-10H,11-12H2,(H2,19,20,21,25)