N-tert-butyl-3-chloranyl-7-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]-1-benzothiophene-2-carboxamide

Systemtic Name: N-tert-butyl-3-chloranyl-7-[(3-propan-2-yloxyphenyl)carbonylcarbamothioylamino]-1-benzothiophene-2-carboxamide Openeye Name: N-tert-butyl-3-chloro-7-[(3-isopropoxybenzoyl)carbamothioylamino]benzothiophene-2-carboxamide CAS Name: N-tert-butyl-3-chloro-7-[[[[oxo-(3-propan-2-yloxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-tert-butyl-3-chloro-7-[(3-propan-2-yloxybenzoyl)carbamothioylamino]-1-benzothiophene-2-carboxamide Traditional Name: N-tert-butyl-3-chloro-7-[(3-isopropoxybenzoyl)thiocarbamoylamino]benzothiophene-2-carboxamide Formula: C24H26ClN3O3S2 MolecularWeight: 504.06454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC3=C2SC(=C3Cl)C(=O)NC(C)(C)C

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC3=C2SC(=C3Cl)C(=O)NC(C)(C)C

InChI

InChI=1S/C24H26ClN3O3S2/c1-13(2)31-15-9-6-8-14(12-15)21(29)27-23(32)26-17-11-7-10-16-18(25)20(33-19(16)17)22(30)28-24(3,4)5/h6-13H,1-5H3,(H,28,30)(H2,26,27,29,32)