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

Systemtic Name: N-(4-methylphenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]-1-pyridin-3-yl-ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-1-(3-pyridyl)ethyl]-N-(p-tolyl)thiadiazole-4-carboxamide CAS Name: N-(4-methylphenyl)-N-[2-oxo-2-[(phenylmethyl)amino]-1-(3-pyridinyl)ethyl]-4-thiadiazolecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxo-1-pyridin-3-ylethyl]-N-(4-methylphenyl)thiadiazole-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-1-(3-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=CN=CC=C2)C(=O)NCC3=CC=CC=C3)C(=O)C4=CSN=N4

Isomeric SMILES

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

InChI

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