N-[3-(1,3-benzothiazol-2-yl)-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-ethylsulfanyl-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-ethylsulfanyl-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-6-isopropyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-ethylsulfanyl-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-(ethylthio)benzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-ethylsulfanylbenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-6-isopropyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-2-(ethylthio)benzamide Formula: C26H27N3OS3 MolecularWeight: 493.70708

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CN(CC3)C(C)C)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CN(CC3)C(C)C)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H27N3OS3/c1-4-31-20-11-7-5-9-18(20)24(30)28-26-23(25-27-19-10-6-8-12-21(19)32-25)17-13-14-29(16(2)3)15-22(17)33-26/h5-12,16H,4,13-15H2,1-3H3,(H,28,30)