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

Systemtic Name: 1-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]thiourea CAS Name: 1-[1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-[1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[1-(2,4-dichlorobenzyl)pyrazol-3-yl]thiourea Formula: C14H14Cl2N4S MolecularWeight: 341.25876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=NN(C=C1)CC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C=CCNC(=S)NC1=NN(C=C1)CC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H14Cl2N4S/c1-2-6-17-14(21)18-13-5-7-20(19-13)9-10-3-4-11(15)8-12(10)16/h2-5,7-8H,1,6,9H2,(H2,17,18,19,21)