3,6-bis(chloranyl)-N-(4-morpholin-4-yl-3-nitro-phenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-(4-morpholin-4-yl-3-nitro-phenyl)-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-(4-morpholino-3-nitro-phenyl)benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[4-(4-morpholinyl)-3-nitrophenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-(4-morpholin-4-yl-3-nitrophenyl)-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-(4-morpholino-3-nitro-phenyl)benzothiophene-2-carboxamide Formula: C19H15Cl2N3O4S MolecularWeight: 452.3111

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H15Cl2N3O4S/c20-11-1-3-13-16(9-11)29-18(17(13)21)19(25)22-12-2-4-14(15(10-12)24(26)27)23-5-7-28-8-6-23/h1-4,9-10H,5-8H2,(H,22,25)