2-(5-isothiocyanato-2-phenyl-1H-indol-3-yl)-2-oxidanylidene-N,N-dipropyl-ethanamide

Systemtic Name: 2-(5-isothiocyanato-2-phenyl-1H-indol-3-yl)-2-oxidanylidene-N,N-dipropyl-ethanamide Openeye Name: 2-(5-isothiocyanato-2-phenyl-1H-indol-3-yl)-2-oxo-N,N-dipropyl-acetamide CAS Name: 2-(5-isothiocyanato-2-phenyl-1H-indol-3-yl)-2-oxo-N,N-dipropylacetamide IUPAC Name: 2-(5-isothiocyanato-2-phenyl-1H-indol-3-yl)-2-oxo-N,N-dipropylacetamide Traditional Name: 2-(5-isothiocyanato-2-phenyl-1H-indol-3-yl)-2-keto-N,N-dipropyl-acetamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C(=O)C1=C(NC2=C1C=C(C=C2)N=C=S)C3=CC=CC=C3

Isomeric SMILES

CCCN(CCC)C(=O)C(=O)C1=C(NC2=C1C=C(C=C2)N=C=S)C3=CC=CC=C3

InChI

InChI=1S/C23H23N3O2S/c1-3-12-26(13-4-2)23(28)22(27)20-18-14-17(24-15-29)10-11-19(18)25-21(20)16-8-6-5-7-9-16/h5-11,14,25H,3-4,12-13H2,1-2H3