2-[2-oxidanylidene-7-(2-pyridin-2-yl-1,3-thiazol-4-yl)-4,5-dihydro-3H-1,4-benzodiazepin-1-yl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-7-(2-pyridin-2-yl-1,3-thiazol-4-yl)-4,5-dihydro-3H-1,4-benzodiazepin-1-yl]ethanoic acid Openeye Name: 2-[2-oxo-7-[2-(2-pyridyl)thiazol-4-yl]-4,5-dihydro-3H-1,4-benzodiazepin-1-yl]acetic acid CAS Name: 2-[2-oxo-7-[2-(2-pyridinyl)-4-thiazolyl]-4,5-dihydro-3H-1,4-benzodiazepin-1-yl]acetic acid IUPAC Name: 2-[2-oxo-7-(2-pyridin-2-yl-1,3-thiazol-4-yl)-4,5-dihydro-3H-1,4-benzodiazepin-1-yl]acetic acid Traditional Name: 2-[2-keto-7-[2-(2-pyridyl)thiazol-4-yl]-4,5-dihydro-3H-1,4-benzodiazepin-1-yl]acetic acid Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)C3=CSC(=N3)C4=CC=CC=N4)N(C(=O)CN1)CC(=O)O

Isomeric SMILES

C1C2=C(C=CC(=C2)C3=CSC(=N3)C4=CC=CC=N4)N(C(=O)CN1)CC(=O)O

InChI

InChI=1S/C19H16N4O3S/c24-17-9-20-8-13-7-12(4-5-16(13)23(17)10-18(25)26)15-11-27-19(22-15)14-3-1-2-6-21-14/h1-7,11,20H,8-10H2,(H,25,26)