[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-bis(thiophen-2-ylmethyl)azanium

Systemtic Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-bis(thiophen-2-ylmethyl)azanium Openeye Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-bis(2-thienylmethyl)ammonium CAS Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-bis(thiophen-2-ylmethyl)ammonium IUPAC Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-bis(thiophen-2-ylmethyl)azanium Traditional Name: [3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl-bis(2-thenyl)ammonium Formula: C21H22N3O3S2+ MolecularWeight: 428.54768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)C[NH+](CC3=CC=CS3)CC4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)C[NH+](CC3=CC=CS3)CC4=CC=CS4)OC

InChI

InChI=1S/C21H21N3O3S2/c1-25-18-8-7-15(11-19(18)26-2)21-22-20(27-23-21)14-24(12-16-5-3-9-28-16)13-17-6-4-10-29-17/h3-11H,12-14H2,1-2H3/p+1