1-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-propan-2-yl-thiourea Openeye Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-isopropyl-thiourea CAS Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-propan-2-ylthiourea IUPAC Name: 1-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-propan-2-ylthiourea Traditional Name: 1-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-isopropyl-thiourea Formula: C15H18ClN5S MolecularWeight: 335.85492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=S)NC(C)C)Cl)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=S)NC(C)C)Cl)C2=CC=CC=C2

InChI

InChI=1S/C15H18ClN5S/c1-10(2)18-15(22)19-17-9-13-11(3)20-21(14(13)16)12-7-5-4-6-8-12/h4-10H,1-3H3,(H2,18,19,22)/b17-9+