1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(Z)-[(5S)-2-methyl-5-prop-1-en-2-yl-cyclohex-2-en-1-ylidene]amino]thiourea

Systemtic Name: 1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-[(Z)-[(5S)-2-methyl-5-prop-1-en-2-yl-cyclohex-2-en-1-ylidene]amino]thiourea Openeye Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-[(Z)-[(5S)-5-isopropenyl-2-methyl-cyclohex-2-en-1-ylidene]amino]thiourea CAS Name: 1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-[(Z)-[(5S)-2-methyl-5-(1-methylethenyl)-1-cyclohex-2-enylidene]amino]thiourea IUPAC Name: 1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-[(Z)-[(5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ylidene]amino]thiourea Traditional Name: 1-[(Z)-[(5S)-5-isopropenyl-2-methyl-cyclohex-2-en-1-ylidene]amino]-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiourea Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(CC1=NNC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C(=C)C

Isomeric SMILES

CC\1=CC[C@@H](C/C1=N/NC(=S)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C(=C)C

InChI

InChI=1S/C22H27N5OS/c1-14(2)17-12-11-15(3)19(13-17)24-25-22(29)23-20-16(4)26(5)27(21(20)28)18-9-7-6-8-10-18/h6-11,17H,1,12-13H2,2-5H3,(H2,23,25,29)/b24-19-/t17-/m0/s1