N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-(4-methyl-2-nitro-phenyl)furan-2-carboxamide

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-(4-methyl-2-nitro-phenyl)furan-2-carboxamide Openeye Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-(4-methyl-2-nitro-phenyl)furan-2-carboxamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-(4-methyl-2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-(4-methyl-2-nitrophenyl)furan-2-carboxamide Traditional Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-(4-methyl-2-nitro-phenyl)-2-furamide Formula: C20H14N4O7S MolecularWeight: 454.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)NC3=NC4=C(C=C(C=C4S3)[N+](=O)[O-])OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)NC3=NC4=C(C=C(C=C4S3)[N+](=O)[O-])OC)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O7S/c1-10-3-4-12(13(7-10)24(28)29)14-5-6-15(31-14)19(25)22-20-21-18-16(30-2)8-11(23(26)27)9-17(18)32-20/h3-9H,1-2H3,(H,21,22,25)