N-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-N-quinolin-3-yl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-N-quinolin-3-yl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]-N-(3-quinolyl)thiadiazole-4-carboxamide CAS Name: N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-N-(3-quinolinyl)-4-thiadiazolecarboxamide IUPAC Name: N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-N-quinolin-3-ylthiadiazole-4-carboxamide Traditional Name: N-[2-keto-2-(p-anisylamino)ethyl]-N-(3-quinolyl)thiadiazole-4-carboxamide Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CN(C2=CC3=CC=CC=C3N=C2)C(=O)C4=CSN=N4

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CN(C2=CC3=CC=CC=C3N=C2)C(=O)C4=CSN=N4

InChI

InChI=1S/C22H19N5O3S/c1-30-18-8-6-15(7-9-18)11-24-21(28)13-27(22(29)20-14-31-26-25-20)17-10-16-4-2-3-5-19(16)23-12-17/h2-10,12,14H,11,13H2,1H3,(H,24,28)