N-[[2-(tert-butylcarbamoyl)-3-chloranyl-1-benzothiophen-7-yl]carbamothioyl]furan-2-carboxamide

Systemtic Name: N-[[2-(tert-butylcarbamoyl)-3-chloranyl-1-benzothiophen-7-yl]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[2-(tert-butylcarbamoyl)-3-chloro-benzothiophen-7-yl]carbamothioyl]furan-2-carboxamide CAS Name: N-[[[2-[(tert-butylamino)-oxomethyl]-3-chloro-1-benzothiophen-7-yl]amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[[2-(tert-butylcarbamoyl)-3-chloro-1-benzothiophen-7-yl]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[2-(tert-butylcarbamoyl)-3-chloro-benzothiophen-7-yl]thiocarbamoyl]-2-furamide Formula: C19H18ClN3O3S2 MolecularWeight: 435.94752

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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=CC=CO3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=S)NC(=O)C3=CC=CO3)Cl

InChI

InChI=1S/C19H18ClN3O3S2/c1-19(2,3)23-17(25)15-13(20)10-6-4-7-11(14(10)28-15)21-18(27)22-16(24)12-8-5-9-26-12/h4-9H,1-3H3,(H,23,25)(H2,21,22,24,27)