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

Systemtic Name: 1-[(Z)-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylideneamino]-3-propan-2-yl-thiourea Openeye Name: 1-[(Z)-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-isopropyl-thiourea CAS Name: 1-[(Z)-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)methylideneamino]-3-propan-2-ylthiourea IUPAC Name: 1-[(Z)-(1-butyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-3-propan-2-ylthiourea Traditional Name: 1-[(Z)-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-isopropyl-thiourea Formula: C13H22ClN5S MolecularWeight: 315.86528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=NNC(=S)NC(C)C)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=N\NC(=S)NC(C)C)Cl

InChI

InChI=1S/C13H22ClN5S/c1-5-6-7-19-12(14)11(10(4)18-19)8-15-17-13(20)16-9(2)3/h8-9H,5-7H2,1-4H3,(H2,16,17,20)/b15-8-