ethyl 2-methylidene-4-(2-thiophen-2-ylethanoylamino)-1,5-dihydro-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 2-methylidene-4-(2-thiophen-2-ylethanoylamino)-1,5-dihydro-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-methylene-4-[[2-(2-thienyl)acetyl]amino]-1,5-dihydro-1,5-benzodiazepine-3-carboxylate CAS Name: 2-methylene-4-[(1-oxo-2-thiophen-2-ylethyl)amino]-1,5-dihydro-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methylidene-4-[(2-thiophen-2-ylacetyl)amino]-1,5-dihydro-1,5-benzodiazepine-3-carboxylate Traditional Name: 2-methylene-4-[[2-(2-thienyl)acetyl]amino]-1,5-dihydro-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC=CC=C2NC1=C)NC(=O)CC3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC=CC=C2NC1=C)NC(=O)CC3=CC=CS3

InChI

InChI=1S/C19H19N3O3S/c1-3-25-19(24)17-12(2)20-14-8-4-5-9-15(14)21-18(17)22-16(23)11-13-7-6-10-26-13/h4-10,20-21H,2-3,11H2,1H3,(H,22,23)