N-[[2-(tert-butylcarbamoyl)-3-chloranyl-1-benzothiophen-7-yl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[[2-(tert-butylcarbamoyl)-3-chloranyl-1-benzothiophen-7-yl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[[2-(tert-butylcarbamoyl)-3-chloro-benzothiophen-7-yl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[[[2-[(tert-butylamino)-oxomethyl]-3-chloro-1-benzothiophen-7-yl]amino]-sulfanylidenemethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[[2-(tert-butylcarbamoyl)-3-chloro-1-benzothiophen-7-yl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[[2-(tert-butylcarbamoyl)-3-chloro-benzothiophen-7-yl]thiocarbamoyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C23H22ClN3O4S2 MolecularWeight: 504.02148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=S)NC(=O)C3=CC4=C(C=C3)OCCO4)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=S)NC(=O)C3=CC4=C(C=C3)OCCO4)Cl

InChI

InChI=1S/C23H22ClN3O4S2/c1-23(2,3)27-21(29)19-17(24)13-5-4-6-14(18(13)33-19)25-22(32)26-20(28)12-7-8-15-16(11-12)31-10-9-30-15/h4-8,11H,9-10H2,1-3H3,(H,27,29)(H2,25,26,28,32)