N-[2-(cyclohexylamino)ethyl]-3-methoxy-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(cyclohexylamino)ethyl]-3-methoxy-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(cyclohexylamino)ethyl]-3-methoxy-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[2-(cyclohexylamino)ethyl]-3-methoxy-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(cyclohexylamino)ethyl]-3-methoxy-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(cyclohexylamino)ethyl]-3-methoxy-5-nitro-benzothiophene-2-carboxamide Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)NCCNC3CCCCC3

Isomeric SMILES

COC1=C(SC2=C1C=C(C=C2)[N+](=O)[O-])C(=O)NCCNC3CCCCC3

InChI

InChI=1S/C18H23N3O4S/c1-25-16-14-11-13(21(23)24)7-8-15(14)26-17(16)18(22)20-10-9-19-12-5-3-2-4-6-12/h7-8,11-12,19H,2-6,9-10H2,1H3,(H,20,22)