3-chloranyl-5-methoxy-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-5-methoxy-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-5-methoxy-N-[4-(4-nitrophenyl)thiazol-2-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-5-methoxy-N-[4-(4-nitrophenyl)-2-thiazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-5-methoxy-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-5-methoxy-N-[4-(4-nitrophenyl)thiazol-2-yl]benzothiophene-2-carboxamide Formula: C19H12ClN3O4S2 MolecularWeight: 445.89928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=C2Cl)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=C2Cl)C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H12ClN3O4S2/c1-27-12-6-7-15-13(8-12)16(20)17(29-15)18(24)22-19-21-14(9-28-19)10-2-4-11(5-3-10)23(25)26/h2-9H,1H3,(H,21,22,24)