1-[[5-bromanyl-1-[(2,5-dimethylphenyl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[[5-bromanyl-1-[(2,5-dimethylphenyl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[[5-bromo-1-[(2,5-dimethylphenyl)methyl]-2-oxo-indolin-3-ylidene]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[5-bromo-1-[(2,5-dimethylphenyl)methyl]-2-oxo-3-indolylidene]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[[5-bromo-1-[(2,5-dimethylphenyl)methyl]-2-oxoindol-3-ylidene]amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[[5-bromo-1-(2,5-dimethylbenzyl)-2-keto-indolin-3-ylidene]amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C27H27BrN4OS MolecularWeight: 535.49848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC4=C(C=CC(=C4)C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC4=C(C=CC(=C4)C)C)C

InChI

InChI=1S/C27H27BrN4OS/c1-5-19-8-6-7-18(4)24(19)29-27(34)31-30-25-22-14-21(28)11-12-23(22)32(26(25)33)15-20-13-16(2)9-10-17(20)3/h6-14H,5,15H2,1-4H3,(H2,29,31,34)