3,6,6-trimethyl-4-oxidanylidene-N-(3-phenylsulfanylpropyl)-5,7-dihydro-1H-indole-2-carboxamide

Systemtic Name: 3,6,6-trimethyl-4-oxidanylidene-N-(3-phenylsulfanylpropyl)-5,7-dihydro-1H-indole-2-carboxamide Openeye Name: 3,6,6-trimethyl-4-oxo-N-(3-phenylsulfanylpropyl)-5,7-dihydro-1H-indole-2-carboxamide CAS Name: 3,6,6-trimethyl-4-oxo-N-[3-(phenylthio)propyl]-5,7-dihydro-1H-indole-2-carboxamide IUPAC Name: 3,6,6-trimethyl-4-oxo-N-(3-phenylsulfanylpropyl)-5,7-dihydro-1H-indole-2-carboxamide Traditional Name: 4-keto-3,6,6-trimethyl-N-[3-(phenylthio)propyl]-5,7-dihydro-1H-indole-2-carboxamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C(=O)CC(C2)(C)C)C(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

CC1=C(NC2=C1C(=O)CC(C2)(C)C)C(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2S/c1-14-18-16(12-21(2,3)13-17(18)24)23-19(14)20(25)22-10-7-11-26-15-8-5-4-6-9-15/h4-6,8-9,23H,7,10-13H2,1-3H3,(H,22,25)