1-(5-chloranylpyridin-2-yl)-3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-(5-chloranylpyridin-2-yl)-3-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-3-(5-chloro-2-pyridyl)thiourea CAS Name: 1-[1-[(4-chlorophenyl)methyl]-4-pyrazolyl]-3-(5-chloro-2-pyridinyl)thiourea IUPAC Name: 1-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-3-(5-chloropyridin-2-yl)thiourea Traditional Name: 1-[1-(4-chlorobenzyl)pyrazol-4-yl]-3-(5-chloro-2-pyridyl)thiourea Formula: C16H13Cl2N5S MolecularWeight: 378.27892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=C(C=N2)NC(=S)NC3=NC=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1CN2C=C(C=N2)NC(=S)NC3=NC=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H13Cl2N5S/c17-12-3-1-11(2-4-12)9-23-10-14(8-20-23)21-16(24)22-15-6-5-13(18)7-19-15/h1-8,10H,9H2,(H2,19,21,22,24)