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

Systemtic Name: 1-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]-3-cyclohexyl-thiourea Openeye Name: 1-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-cyclohexyl-thiourea CAS Name: 1-[(E)-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]-3-cyclohexylthiourea IUPAC Name: 1-[(E)-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-3-cyclohexylthiourea Traditional Name: 1-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-3-cyclohexyl-thiourea Formula: C19H24ClN5S MolecularWeight: 389.94536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=S)NC2CCCCC2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=S)NC2CCCCC2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C19H24ClN5S/c1-14-17(12-21-23-19(26)22-16-10-6-3-7-11-16)18(20)25(24-14)13-15-8-4-2-5-9-15/h2,4-5,8-9,12,16H,3,6-7,10-11,13H2,1H3,(H2,22,23,26)/b21-12+