[(3E)-3-(azepan-2-ylidene)-2-oxidanylidene-indol-1-yl]carbothioyl-propylidene-azanium

Systemtic Name: [(3E)-3-(azepan-2-ylidene)-2-oxidanylidene-indol-1-yl]carbothioyl-propylidene-azanium Openeye Name: [(3E)-3-(azepan-2-ylidene)-2-oxo-indoline-1-carbothioyl]-propylidene-ammonium CAS Name: [[(3E)-3-(2-azepanylidene)-2-oxo-1-indolyl]-sulfanylidenemethyl]-propylideneammonium IUPAC Name: [(3E)-3-(azepan-2-ylidene)-2-oxoindole-1-carbothioyl]-propylideneazanium Traditional Name: [(3E)-3-(azepan-2-ylidene)-2-keto-indoline-1-carbothioyl]-propylidene-ammonium Formula: C18H22N3OS+ MolecularWeight: 328.45178

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Descriptors Computed from Structure

Canonical SMILES:

CCC=[NH+]C(=S)N1C2=CC=CC=C2C(=C3CCCCCN3)C1=O

Isomeric SMILES

CCC=[NH+]C(=S)N1C2=CC=CC=C2/C(=C\3/CCCCCN3)/C1=O

InChI

InChI=1S/C18H21N3OS/c1-2-11-20-18(23)21-15-10-6-5-8-13(15)16(17(21)22)14-9-4-3-7-12-19-14/h5-6,8,10-11,19H,2-4,7,9,12H2,1H3/p+1/b16-14+,20-11?