3-azanyl-6-(4-methoxyphenyl)-N-(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-6-(4-methoxyphenyl)-N-(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-(2-allylsulfanyl-1,3-benzothiazol-6-yl)-3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-6-(4-methoxyphenyl)-N-[2-(prop-2-enylthio)-1,3-benzothiazol-6-yl]-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-6-(4-methoxyphenyl)-N-(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-[2-(allylthio)-1,3-benzothiazol-6-yl]-3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C25H20N4O2S3 MolecularWeight: 504.6469

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)NC4=CC5=C(C=C4)N=C(S5)SCC=C)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)NC4=CC5=C(C=C4)N=C(S5)SCC=C)N

InChI

InChI=1S/C25H20N4O2S3/c1-3-12-32-25-29-19-10-6-15(13-20(19)33-25)27-23(30)22-21(26)17-9-11-18(28-24(17)34-22)14-4-7-16(31-2)8-5-14/h3-11,13H,1,12,26H2,2H3,(H,27,30)