N-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-2-yl)-4-methoxy-3-nitro-benzamide

Systemtic Name: N-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-2-yl)-4-methoxy-3-nitro-benzamide Openeye Name: N-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-2-yl)-4-methoxy-3-nitro-benzamide CAS Name: N-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-2-yl)-4-methoxy-3-nitrobenzamide IUPAC Name: N-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-2-yl)-4-methoxy-3-nitrobenzamide Traditional Name: N-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]thiopyran-2-yl)-4-methoxy-3-nitro-benzamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(CS1)SC(=C2C#N)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC2=C(CS1)SC(=C2C#N)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C18H17N3O4S2/c1-18(2)7-11-12(8-19)17(27-15(11)9-26-18)20-16(22)10-4-5-14(25-3)13(6-10)21(23)24/h4-6H,7,9H2,1-3H3,(H,20,22)