4-[2-[(2-chloranylpyridin-4-yl)carbonylamino]-4-methoxy-1,3-benzothiazol-7-yl]-3,6-dihydro-2H-pyridine-1-carboxylic acid

Systemtic Name: 4-[2-[(2-chloranylpyridin-4-yl)carbonylamino]-4-methoxy-1,3-benzothiazol-7-yl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Openeye Name: 4-[2-[(2-chloropyridine-4-carbonyl)amino]-4-methoxy-1,3-benzothiazol-7-yl]-3,6-dihydro-2H-pyridine-1-carboxylic acid CAS Name: 4-[2-[[(2-chloro-4-pyridinyl)-oxomethyl]amino]-4-methoxy-1,3-benzothiazol-7-yl]-3,6-dihydro-2H-pyridine-1-carboxylic acid IUPAC Name: 4-[2-[(2-chloropyridine-4-carbonyl)amino]-4-methoxy-1,3-benzothiazol-7-yl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Traditional Name: 4-[2-[(2-chloroisonicotinoyl)amino]-4-methoxy-1,3-benzothiazol-7-yl]-3,6-dihydro-2H-pyridine-1-carboxylic acid Formula: C20H17ClN4O4S MolecularWeight: 444.89138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=CCN(CC3)C(=O)O)SC(=N2)NC(=O)C4=CC(=NC=C4)Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=CCN(CC3)C(=O)O)SC(=N2)NC(=O)C4=CC(=NC=C4)Cl

InChI

InChI=1S/C20H17ClN4O4S/c1-29-14-3-2-13(11-5-8-25(9-6-11)20(27)28)17-16(14)23-19(30-17)24-18(26)12-4-7-22-15(21)10-12/h2-5,7,10H,6,8-9H2,1H3,(H,27,28)(H,23,24,26)