2-[(3E)-3-(1,3-benzothiazol-2-ylhydrazinylidene)-2-oxidanylidene-indol-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[(3E)-3-(1,3-benzothiazol-2-ylhydrazinylidene)-2-oxidanylidene-indol-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[(3E)-3-(1,3-benzothiazol-2-ylhydrazono)-2-oxo-indolin-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[(3E)-3-(1,3-benzothiazol-2-ylhydrazinylidene)-2-oxo-1-indolyl]ethyl-diethylammonium IUPAC Name: 2-[(3E)-3-(1,3-benzothiazol-2-ylhydrazinylidene)-2-oxoindol-1-yl]ethyl-diethylazanium Traditional Name: 2-[(3E)-3-(1,3-benzothiazol-2-ylhydrazono)-2-keto-indolin-1-yl]ethyl-diethyl-ammonium Formula: C21H24N5OS+ MolecularWeight: 394.51316

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2C(=NNC3=NC4=CC=CC=C4S3)C1=O

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2/C(=N\NC3=NC4=CC=CC=C4S3)/C1=O

InChI

InChI=1S/C21H23N5OS/c1-3-25(4-2)13-14-26-17-11-7-5-9-15(17)19(20(26)27)23-24-21-22-16-10-6-8-12-18(16)28-21/h5-12H,3-4,13-14H2,1-2H3,(H,22,24)/p+1/b23-19+