6-chloranyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-1-propan-2-yl-quinoline-3-carboximidate

Systemtic Name: 6-chloranyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-1-propan-2-yl-quinoline-3-carboximidate Openeye Name: 6-chloro-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-1-isopropyl-4-oxo-quinoline-3-carboximidate CAS Name: 6-chloro-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1-propan-2-yl-3-quinolinecarboximidate IUPAC Name: 6-chloro-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1-propan-2-ylquinoline-3-carboximidate Traditional Name: 6-chloro-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-1-isopropyl-4-keto-quinoline-3-carboximidate Formula: C19H20ClN4O2S- MolecularWeight: 403.9057

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)N=C(C2=CN(C3=C(C2=O)C=C(C=C3)Cl)C(C)C)[O-]

Isomeric SMILES

CC(C)CC1=NN=C(S1)N=C(C2=CN(C3=C(C2=O)C=C(C=C3)Cl)C(C)C)[O-]

InChI

InChI=1S/C19H21ClN4O2S/c1-10(2)7-16-22-23-19(27-16)21-18(26)14-9-24(11(3)4)15-6-5-12(20)8-13(15)17(14)25/h5-6,8-11H,7H2,1-4H3,(H,21,23,26)/p-1