N-(4-butoxyphenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-(4-butoxyphenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-N-(4-butoxyphenyl)thiadiazole-4-carboxamide CAS Name: N-(4-butoxyphenyl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4-thiadiazolecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-N-(4-butoxyphenyl)thiadiazole-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-N-(4-butoxyphenyl)thiadiazole-4-carboxamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N(CC(=O)NCC2=CC=CC=C2)C(=O)C3=CSN=N3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N(CC(=O)NCC2=CC=CC=C2)C(=O)C3=CSN=N3

InChI

InChI=1S/C22H24N4O3S/c1-2-3-13-29-19-11-9-18(10-12-19)26(22(28)20-16-30-25-24-20)15-21(27)23-14-17-7-5-4-6-8-17/h4-12,16H,2-3,13-15H2,1H3,(H,23,27)