1-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[1-[(3,4-dichlorophenyl)methyl]-4-pyrazolyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[1-[(3,4-dichlorophenyl)methyl]pyrazol-4-yl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[1-(3,4-dichlorobenzyl)pyrazol-4-yl]-3-(4-methoxyphenyl)thiourea Formula: C18H16Cl2N4OS MolecularWeight: 407.31684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NC2=CN(N=C2)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NC2=CN(N=C2)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H16Cl2N4OS/c1-25-15-5-3-13(4-6-15)22-18(26)23-14-9-21-24(11-14)10-12-2-7-16(19)17(20)8-12/h2-9,11H,10H2,1H3,(H2,22,23,26)