1-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-phenyl-thiourea

Systemtic Name: 1-[3-[(4-chloranylpyrazol-1-yl)methyl]phenyl]-3-phenyl-thiourea Openeye Name: 1-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-phenyl-thiourea CAS Name: 1-[3-[(4-chloro-1-pyrazolyl)methyl]phenyl]-3-phenylthiourea IUPAC Name: 1-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-phenylthiourea Traditional Name: 1-[3-[(4-chloropyrazol-1-yl)methyl]phenyl]-3-phenyl-thiourea Formula: C17H15ClN4S MolecularWeight: 342.8458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)CN3C=C(C=N3)Cl

InChI

InChI=1S/C17H15ClN4S/c18-14-10-19-22(12-14)11-13-5-4-8-16(9-13)21-17(23)20-15-6-2-1-3-7-15/h1-10,12H,11H2,(H2,20,21,23)