N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3-(5-nitrothiophen-2-yl)prop-2-enamide

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3-(5-nitrothiophen-2-yl)prop-2-enamide Openeye Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3-(5-nitro-2-thienyl)prop-2-enamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3-(5-nitro-2-thiophenyl)-2-propenamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3-(5-nitrothiophen-2-yl)prop-2-enamide Traditional Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3-(5-nitro-2-thienyl)acrylamide Formula: C15H10N4O6S2 MolecularWeight: 406.3931

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)NC(=O)C=CC3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)NC(=O)C=CC3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C15H10N4O6S2/c1-25-10-6-8(18(21)22)7-11-14(10)17-15(27-11)16-12(20)4-2-9-3-5-13(26-9)19(23)24/h2-7H,1H3,(H,16,17,20)