butan-2-yl 2-azanyl-4-[4-[2-(5-oxidanylidene-2H-1,2,4-thiadiazol-3-yl)phenyl]phenyl]pyridine-3-carboxylate

Systemtic Name: butan-2-yl 2-azanyl-4-[4-[2-(5-oxidanylidene-2H-1,2,4-thiadiazol-3-yl)phenyl]phenyl]pyridine-3-carboxylate Openeye Name: sec-butyl 2-amino-4-[4-[2-(5-oxo-2H-1,2,4-thiadiazol-3-yl)phenyl]phenyl]pyridine-3-carboxylate CAS Name: 2-amino-4-[4-[2-(5-oxo-2H-1,2,4-thiadiazol-3-yl)phenyl]phenyl]-3-pyridinecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-amino-4-[4-[2-(5-oxo-2H-1,2,4-thiadiazol-3-yl)phenyl]phenyl]pyridine-3-carboxylate Traditional Name: 2-amino-4-[4-[2-(5-keto-2H-1,2,4-thiadiazol-3-yl)phenyl]phenyl]nicotinic acid sec-butyl ester Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=C(C=CN=C1N)C2=CC=C(C=C2)C3=CC=CC=C3C4=NC(=O)SN4

Isomeric SMILES

CCC(C)OC(=O)C1=C(C=CN=C1N)C2=CC=C(C=C2)C3=CC=CC=C3C4=NC(=O)SN4

InChI

InChI=1S/C24H22N4O3S/c1-3-14(2)31-23(29)20-18(12-13-26-21(20)25)16-10-8-15(9-11-16)17-6-4-5-7-19(17)22-27-24(30)32-28-22/h4-14H,3H2,1-2H3,(H2,25,26)(H,27,28,30)