ethyl 5-azanyl-1-phenyl-[1,3]thiazolo[3,2-a][1,5]benzodiazepine-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-phenyl-[1,3]thiazolo[3,2-a][1,5]benzodiazepine-4-carboxylate Openeye Name: ethyl 5-amino-1-phenyl-thiazolo[3,2-a][1,5]benzodiazepine-4-carboxylate CAS Name: 5-amino-1-phenyl-4-thiazolo[3,2-a][1,5]benzodiazepinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-phenyl-[1,3]thiazolo[3,2-a][1,5]benzodiazepine-4-carboxylate Traditional Name: 5-amino-1-phenyl-thiazolo[3,2-a][1,5]benzodiazepine-4-carboxylic acid ethyl ester Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N(C3=CC=CC=C3N=C1N)C(=CS2)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C2N(C3=CC=CC=C3N=C1N)C(=CS2)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O2S/c1-2-25-20(24)17-18(21)22-14-10-6-7-11-15(14)23-16(12-26-19(17)23)13-8-4-3-5-9-13/h3-12H,2H2,1H3,(H2,21,22)