N-[1-(3-methylthiophen-2-yl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N-prop-2-enyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[1-(3-methylthiophen-2-yl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N-prop-2-enyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-allyl-N-[2-(benzylamino)-1-(3-methyl-2-thienyl)-2-oxo-ethyl]thiadiazole-4-carboxamide CAS Name: N-[1-(3-methyl-2-thiophenyl)-2-oxo-2-[(phenylmethyl)amino]ethyl]-N-prop-2-enyl-4-thiadiazolecarboxamide IUPAC Name: N-[2-(benzylamino)-1-(3-methylthiophen-2-yl)-2-oxoethyl]-N-prop-2-enylthiadiazole-4-carboxamide Traditional Name: N-allyl-N-[2-(benzylamino)-2-keto-1-(3-methyl-2-thienyl)ethyl]thiadiazole-4-carboxamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C(=O)NCC2=CC=CC=C2)N(CC=C)C(=O)C3=CSN=N3

Isomeric SMILES

CC1=C(SC=C1)C(C(=O)NCC2=CC=CC=C2)N(CC=C)C(=O)C3=CSN=N3

InChI

InChI=1S/C20H20N4O2S2/c1-3-10-24(20(26)16-13-28-23-22-16)17(18-14(2)9-11-27-18)19(25)21-12-15-7-5-4-6-8-15/h3-9,11,13,17H,1,10,12H2,2H3,(H,21,25)