ethyl 4-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonylamino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 4-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonylamino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 4-[(2,4-dimethylthiazole-5-carbonyl)amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 4-[[(2,4-dimethyl-5-thiazolyl)-oxomethyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2,4-dimethyl-1,3-thiazole-5-carbonyl)amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 4-[(2,4-dimethylthiazole-5-carbonyl)amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C20H22N4O3S MolecularWeight: 398.47868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=C(N=C(S3)C)C)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=C(N=C(S3)C)C)C(=O)OCC

InChI

InChI=1S/C20H22N4O3S/c1-5-13-16(20(26)27-6-2)18(23-15-10-8-7-9-14(15)22-13)24-19(25)17-11(3)21-12(4)28-17/h7-10,22H,5-6H2,1-4H3,(H,23,24,25)