bis[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxidanylidene-ethyl]-propan-2-yl-azanium

Systemtic Name: bis[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxidanylidene-ethyl]-propan-2-yl-azanium Openeye Name: bis[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxo-ethyl]-isopropyl-ammonium CAS Name: bis[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxoethyl]-propan-2-ylammonium IUPAC Name: bis[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxoethyl]-propan-2-ylazanium Traditional Name: bis[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-keto-ethyl]-isopropyl-ammonium Formula: C21H28N3O2S2+ MolecularWeight: 418.59592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC(=O)N1CCC2=C(C1)C=CS2)CC(=O)N3CCC4=C(C3)C=CS4

Isomeric SMILES

CC(C)[NH+](CC(=O)N1CCC2=C(C1)C=CS2)CC(=O)N3CCC4=C(C3)C=CS4

InChI

InChI=1S/C21H27N3O2S2/c1-15(2)24(13-20(25)22-7-3-18-16(11-22)5-9-27-18)14-21(26)23-8-4-19-17(12-23)6-10-28-19/h5-6,9-10,15H,3-4,7-8,11-14H2,1-2H3/p+1