6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone

Systemtic Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone Openeye Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone CAS Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[5-nitro-2-(1-pyrrolidinyl)phenyl]methanone IUPAC Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(5-nitro-2-pyrrolidin-1-ylphenyl)methanone Traditional Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(5-nitro-2-pyrrolidino-phenyl)methanone Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCC4=C(C3)C=CS4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCC4=C(C3)C=CS4

InChI

InChI=1S/C18H19N3O3S/c22-18(20-9-5-17-13(12-20)6-10-25-17)15-11-14(21(23)24)3-4-16(15)19-7-1-2-8-19/h3-4,6,10-11H,1-2,5,7-9,12H2