N-tert-butyl-3-chloranyl-7-[(5-chloranylnaphthalen-1-yl)carbonylcarbamothioylamino]-1-benzothiophene-2-carboxamide

Systemtic Name: N-tert-butyl-3-chloranyl-7-[(5-chloranylnaphthalen-1-yl)carbonylcarbamothioylamino]-1-benzothiophene-2-carboxamide Openeye Name: N-tert-butyl-3-chloro-7-[(5-chloronaphthalene-1-carbonyl)carbamothioylamino]benzothiophene-2-carboxamide CAS Name: N-tert-butyl-3-chloro-7-[[[[(5-chloro-1-naphthalenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-1-benzothiophene-2-carboxamide IUPAC Name: N-tert-butyl-3-chloro-7-[(5-chloronaphthalene-1-carbonyl)carbamothioylamino]-1-benzothiophene-2-carboxamide Traditional Name: N-tert-butyl-3-chloro-7-[(5-chloro-1-naphthoyl)thiocarbamoylamino]benzothiophene-2-carboxamide Formula: C25H21Cl2N3O2S2 MolecularWeight: 530.48914

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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=CC4=C3C=CC=C4Cl)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Cl)Cl

InChI

InChI=1S/C25H21Cl2N3O2S2/c1-25(2,3)30-23(32)21-19(27)16-10-6-12-18(20(16)34-21)28-24(33)29-22(31)15-9-4-8-14-13(15)7-5-11-17(14)26/h4-12H,1-3H3,(H,30,32)(H2,28,29,31,33)