1-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-ethyl-thiourea

Systemtic Name: 1-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-ethyl-thiourea Openeye Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-ethyl-thiourea CAS Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-ethylthiourea IUPAC Name: 1-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-ethylthiourea Traditional Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-ethyl-thiourea Formula: C14H16ClN5S MolecularWeight: 321.82834

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(N(N=C1C)C2=CC=CC=C2)Cl

Isomeric SMILES

CCNC(=S)N/N=C/C1=C(N(N=C1C)C2=CC=CC=C2)Cl

InChI

InChI=1S/C14H16ClN5S/c1-3-16-14(21)18-17-9-12-10(2)19-20(13(12)15)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H2,16,18,21)/b17-9+