N,N-bis(2-cyanoethyl)-2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzamide

Systemtic Name: N,N-bis(2-cyanoethyl)-2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzamide Openeye Name: N,N-bis(2-cyanoethyl)-2-methyl-5-[2-(2-pyridylamino)thiazol-5-yl]sulfanyl-benzamide CAS Name: N,N-bis(2-cyanoethyl)-2-methyl-5-[[2-(2-pyridinylamino)-5-thiazolyl]thio]benzamide IUPAC Name: N,N-bis(2-cyanoethyl)-2-methyl-5-[[2-(pyridin-2-ylamino)-1,3-thiazol-5-yl]sulfanyl]benzamide Traditional Name: N,N-bis(2-cyanoethyl)-2-methyl-5-[[2-(2-pyridylamino)thiazol-5-yl]thio]benzamide Formula: C22H20N6OS2 MolecularWeight: 448.5638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=CN=C(S2)NC3=CC=CC=N3)C(=O)N(CCC#N)CCC#N

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=CN=C(S2)NC3=CC=CC=N3)C(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C22H20N6OS2/c1-16-7-8-17(14-18(16)21(29)28(12-4-9-23)13-5-10-24)30-20-15-26-22(31-20)27-19-6-2-3-11-25-19/h2-3,6-8,11,14-15H,4-5,12-13H2,1H3,(H,25,26,27)