3-chloranyl-N-[(cyclohexylcarbonylamino)carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(cyclohexylcarbonylamino)carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(cyclohexanecarbonylamino)carbamothioyl]-6-methoxy-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[[cyclohexyl(oxo)methyl]hydrazo]-sulfanylidenemethyl]-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(cyclohexanecarbonylamino)carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(cyclohexanecarbonylamino)thiocarbamoyl]-6-methoxy-benzothiophene-2-carboxamide Formula: C18H20ClN3O3S2 MolecularWeight: 425.9527

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)C3CCCCC3)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)C3CCCCC3)Cl

InChI

InChI=1S/C18H20ClN3O3S2/c1-25-11-7-8-12-13(9-11)27-15(14(12)19)17(24)20-18(26)22-21-16(23)10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H,21,23)(H2,20,22,24,26)