methyl 3-[[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylethanoyl]hydrazinyl]methylidene]indole-7-carboxylate

Systemtic Name: methyl 3-[[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylethanoyl]hydrazinyl]methylidene]indole-7-carboxylate Openeye Name: methyl 3-[[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylacetyl]hydrazino]methylene]indole-7-carboxylate CAS Name: 3-[[[2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-1-oxoethyl]hydrazo]methylidene]-7-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylacetyl]hydrazinyl]methylidene]indole-7-carboxylate Traditional Name: 3-[[N'-[2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]acetyl]hydrazino]methylene]indole-7-carboxylic acid methyl ester Formula: C27H33N3O4S MolecularWeight: 495.63362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC(=O)NNC=C2C=NC3=C2C=CC=C3C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC(=O)NNC=C2C=NC3=C2C=CC=C3C(=O)OC

InChI

InChI=1S/C27H33N3O4S/c1-26(2,3)20-11-17(12-21(24(20)32)27(4,5)6)35-15-22(31)30-29-14-16-13-28-23-18(16)9-8-10-19(23)25(33)34-7/h8-14,29,32H,15H2,1-7H3,(H,30,31)