8-oxidanyl-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]quinoline-7-carboxamide hydrochloride

Systemtic Name: 8-oxidanyl-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]quinoline-7-carboxamide hydrochloride Openeye Name: 8-hydroxy-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]quinoline-7-carboxamide hydrochloride CAS Name: 8-hydroxy-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]-7-quinolinecarboxamide hydrochloride IUPAC Name: 8-hydroxy-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]quinoline-7-carboxamide hydrochloride Traditional Name: 8-hydroxy-N-[5-(phenethylamino)-1,3,4-thiadiazol-2-yl]quinoline-7-carboxamide hydrochloride Formula: C20H18ClN5O2S MolecularWeight: 427.90722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NN=C(S2)NC(=O)C3=C(C4=C(C=CC=N4)C=C3)O.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NN=C(S2)NC(=O)C3=C(C4=C(C=CC=N4)C=C3)O.Cl

InChI

InChI=1S/C20H17N5O2S.ClH/c26-17-15(9-8-14-7-4-11-21-16(14)17)18(27)23-20-25-24-19(28-20)22-12-10-13-5-2-1-3-6-13;/h1-9,11,26H,10,12H2,(H,22,24)(H,23,25,27);1H