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

Systemtic Name: N-(4-methylphenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]-1-pyridin-4-yl-ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-1-(4-pyridyl)ethyl]-N-(p-tolyl)thiadiazole-4-carboxamide CAS Name: N-(4-methylphenyl)-N-[2-oxo-2-[(phenylmethyl)amino]-1-pyridin-4-ylethyl]-4-thiadiazolecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(4-methylphenyl)thiadiazole-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-1-(4-pyridyl)ethyl]-N-(p-tolyl)thiadiazole-4-carboxamide Formula: C24H21N5O2S MolecularWeight: 443.52084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(C2=CC=NC=C2)C(=O)NCC3=CC=CC=C3)C(=O)C4=CSN=N4

Isomeric SMILES

CC1=CC=C(C=C1)N(C(C2=CC=NC=C2)C(=O)NCC3=CC=CC=C3)C(=O)C4=CSN=N4

InChI

InChI=1S/C24H21N5O2S/c1-17-7-9-20(10-8-17)29(24(31)21-16-32-28-27-21)22(19-11-13-25-14-12-19)23(30)26-15-18-5-3-2-4-6-18/h2-14,16,22H,15H2,1H3,(H,26,30)