2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]indolizine-1-carbonitrile

Systemtic Name: 2-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]indolizine-1-carbonitrile Openeye Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]indolizine-1-carbonitrile CAS Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]-1-indolizinecarbonitrile IUPAC Name: 2-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]indolizine-1-carbonitrile Traditional Name: 2-[(1,1,3-triketo-1,2-benzothiazol-2-yl)methyl]indolizine-1-carbonitrile Formula: C17H11N3O3S MolecularWeight: 337.35254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2(=O)=O)CC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C17H11N3O3S/c18-9-14-12(10-19-8-4-3-6-15(14)19)11-20-17(21)13-5-1-2-7-16(13)24(20,22)23/h1-8,10H,11H2