3-chloranyl-N-[(cyclohexylcarbonylamino)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(cyclohexylcarbonylamino)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(cyclohexanecarbonylamino)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[[cyclohexyl(oxo)methyl]hydrazo]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(cyclohexanecarbonylamino)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(cyclohexanecarbonylamino)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C17H18ClN3O2S2 MolecularWeight: 395.92672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NNC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)NNC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H18ClN3O2S2/c18-13-11-8-4-5-9-12(11)25-14(13)16(23)19-17(24)21-20-15(22)10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,20,22)(H2,19,21,23,24)