1-butyl-3-[(Z)-[1-methyl-2-oxidanylidene-5-(trifluoromethyloxy)indol-3-ylidene]amino]thiourea

Systemtic Name: 1-butyl-3-[(Z)-[1-methyl-2-oxidanylidene-5-(trifluoromethyloxy)indol-3-ylidene]amino]thiourea Openeye Name: 1-butyl-3-[(Z)-[1-methyl-2-oxo-5-(trifluoromethoxy)indolin-3-ylidene]amino]thiourea CAS Name: 1-butyl-3-[(Z)-[1-methyl-2-oxo-5-(trifluoromethoxy)-3-indolylidene]amino]thiourea IUPAC Name: 1-butyl-3-[(Z)-[1-methyl-2-oxo-5-(trifluoromethoxy)indol-3-ylidene]amino]thiourea Traditional Name: 1-butyl-3-[(Z)-[2-keto-1-methyl-5-(trifluoromethoxy)indolin-3-ylidene]amino]thiourea Formula: C15H17F3N4O2S MolecularWeight: 374.38129

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=C1C2=C(C=CC(=C2)OC(F)(F)F)N(C1=O)C

Isomeric SMILES

CCCCNC(=S)N/N=C\1/C2=C(C=CC(=C2)OC(F)(F)F)N(C1=O)C

InChI

InChI=1S/C15H17F3N4O2S/c1-3-4-7-19-14(25)21-20-12-10-8-9(24-15(16,17)18)5-6-11(10)22(2)13(12)23/h5-6,8H,3-4,7H2,1-2H3,(H2,19,21,25)/b20-12-