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

Systemtic Name: 1-butyl-3-[(Z)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]thiourea Openeye Name: 1-[(Z)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-butyl-thiourea CAS Name: 1-butyl-3-[(Z)-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-[(Z)-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-3-butylthiourea Traditional Name: 1-[(Z)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-butyl-thiourea Formula: C17H22ClN5S MolecularWeight: 363.90808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=C(N(N=C1C)CC2=CC=CC=C2)Cl

Isomeric SMILES

CCCCNC(=S)N/N=C\C1=C(N(N=C1C)CC2=CC=CC=C2)Cl

InChI

InChI=1S/C17H22ClN5S/c1-3-4-10-19-17(24)21-20-11-15-13(2)22-23(16(15)18)12-14-8-6-5-7-9-14/h5-9,11H,3-4,10,12H2,1-2H3,(H2,19,21,24)/b20-11-