7-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylcarbamothioylamino]-N-tert-butyl-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: 7-[(4-bromanyl-3-methoxy-naphthalen-2-yl)carbonylcarbamothioylamino]-N-tert-butyl-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: 7-[(4-bromo-3-methoxy-naphthalene-2-carbonyl)carbamothioylamino]-N-tert-butyl-3-chloro-benzothiophene-2-carboxamide CAS Name: 7-[[[[(4-bromo-3-methoxy-2-naphthalenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-tert-butyl-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: 7-[(4-bromo-3-methoxynaphthalene-2-carbonyl)carbamothioylamino]-N-tert-butyl-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: 7-[(4-bromo-3-methoxy-2-naphthoyl)thiocarbamoylamino]-N-tert-butyl-3-chloro-benzothiophene-2-carboxamide Formula: C26H23BrClN3O3S2 MolecularWeight: 604.96612

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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=CC=CC=C4C(=C3OC)Br)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4C(=C3OC)Br)Cl

InChI

InChI=1S/C26H23BrClN3O3S2/c1-26(2,3)31-24(33)22-19(28)15-10-7-11-17(21(15)36-22)29-25(35)30-23(32)16-12-13-8-5-6-9-14(13)18(27)20(16)34-4/h5-12H,1-4H3,(H,31,33)(H2,29,30,32,35)