4-cyano-3-methyl-2-[(Z)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]pyrido[1,2-a]benzimidazol-1-olate

Systemtic Name: 4-cyano-3-methyl-2-[(Z)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]pyrido[1,2-a]benzimidazol-1-olate Openeye Name: 4-cyano-3-methyl-2-[(Z)-(3-oxobenzothiophen-2-ylidene)methyl]pyrido[1,2-a]benzimidazol-1-olate CAS Name: 4-cyano-3-methyl-2-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]-1-pyrido[1,2-a]benzimidazololate IUPAC Name: 4-cyano-3-methyl-2-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]pyrido[1,2-a]benzimidazol-1-olate Traditional Name: 4-cyano-2-[(Z)-(3-ketobenzothiophen-2-ylidene)methyl]-3-methyl-pyrido[1,2-a]benzimidazol-1-olate Formula: C22H12N3O2S- MolecularWeight: 382.41458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1C=C4C(=O)C5=CC=CC=C5S4)[O-])C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1/C=C\4/C(=O)C5=CC=CC=C5S4)[O-])C#N

InChI

InChI=1S/C22H13N3O2S/c1-12-14(10-19-20(26)13-6-2-5-9-18(13)28-19)22(27)25-17-8-4-3-7-16(17)24-21(25)15(12)11-23/h2-10,27H,1H3/p-1/b19-10-