1-[[1-(2,4-dichlorophenyl)-4-methyl-5-selenophen-2-yl-pyrazol-3-yl]methyl]-3-phenyl-thiourea

Systemtic Name: 1-[[1-(2,4-dichlorophenyl)-4-methyl-5-selenophen-2-yl-pyrazol-3-yl]methyl]-3-phenyl-thiourea Openeye Name: 1-[[1-(2,4-dichlorophenyl)-4-methyl-5-selenophen-2-yl-pyrazol-3-yl]methyl]-3-phenyl-thiourea CAS Name: 1-[[1-(2,4-dichlorophenyl)-4-methyl-5-(2-selenophenyl)-3-pyrazolyl]methyl]-3-phenylthiourea IUPAC Name: 1-[[1-(2,4-dichlorophenyl)-4-methyl-5-selenophen-2-ylpyrazol-3-yl]methyl]-3-phenylthiourea Traditional Name: 1-[[1-(2,4-dichlorophenyl)-4-methyl-5-selenophen-2-yl-pyrazol-3-yl]methyl]-3-phenyl-thiourea Formula: C22H18Cl2N4SSe MolecularWeight: 520.33612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1CNC(=S)NC2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C[Se]4

Isomeric SMILES

CC1=C(N(N=C1CNC(=S)NC2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C[Se]4

InChI

InChI=1S/C22H18Cl2N4SSe/c1-14-18(13-25-22(29)26-16-6-3-2-4-7-16)27-28(21(14)20-8-5-11-30-20)19-10-9-15(23)12-17(19)24/h2-12H,13H2,1H3,(H2,25,26,29)