N-tert-butyl-3-chloranyl-7-[(3,4-dimethoxyphenyl)carbonylcarbamothioylamino]-1-benzothiophene-2-carboxamide

Systemtic Name: N-tert-butyl-3-chloranyl-7-[(3,4-dimethoxyphenyl)carbonylcarbamothioylamino]-1-benzothiophene-2-carboxamide Openeye Name: N-tert-butyl-3-chloro-7-[(3,4-dimethoxybenzoyl)carbamothioylamino]benzothiophene-2-carboxamide CAS Name: N-tert-butyl-3-chloro-7-[[[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-tert-butyl-3-chloro-7-[(3,4-dimethoxybenzoyl)carbamothioylamino]-1-benzothiophene-2-carboxamide Traditional Name: N-tert-butyl-3-chloro-7-(veratroylthiocarbamoylamino)benzothiophene-2-carboxamide Formula: C23H24ClN3O4S2 MolecularWeight: 506.03736

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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(=C(C=C3)OC)OC)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H24ClN3O4S2/c1-23(2,3)27-21(29)19-17(24)13-7-6-8-14(18(13)33-19)25-22(32)26-20(28)12-9-10-15(30-4)16(11-12)31-5/h6-11H,1-5H3,(H,27,29)(H2,25,26,28,32)