ethyl 2-azanylidene-5-(1H-benzimidazol-2-yl)-4-phenyl-thiolane-3-carboxylate

Systemtic Name: ethyl 2-azanylidene-5-(1H-benzimidazol-2-yl)-4-phenyl-thiolane-3-carboxylate Openeye Name: ethyl 5-(1H-benzimidazol-2-yl)-2-imino-4-phenyl-tetrahydrothiophene-3-carboxylate CAS Name: 5-(1H-benzimidazol-2-yl)-2-imino-4-phenyl-3-thiolanecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1H-benzimidazol-2-yl)-2-imino-4-phenylthiolane-3-carboxylate Traditional Name: 5-(1H-benzimidazol-2-yl)-2-imino-4-phenyl-tetrahydrothiophene-3-carboxylic acid ethyl ester Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(SC1=N)C2=NC3=CC=CC=C3N2)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1C(C(SC1=N)C2=NC3=CC=CC=C3N2)C4=CC=CC=C4

InChI

InChI=1S/C20H19N3O2S/c1-2-25-20(24)16-15(12-8-4-3-5-9-12)17(26-18(16)21)19-22-13-10-6-7-11-14(13)23-19/h3-11,15-17,21H,2H2,1H3,(H,22,23)