4-[(R)-[1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]-thiophen-2-yl-methyl]thiomorpholin-4-ium

Systemtic Name: 4-[(R)-[1-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrazol-5-yl]-thiophen-2-yl-methyl]thiomorpholin-4-ium Openeye Name: 4-[(R)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]-(2-thienyl)methyl]thiomorpholin-4-ium CAS Name: 4-[(R)-[1-[(4-methoxyphenyl)methyl]-5-tetrazolyl]-thiophen-2-ylmethyl]thiomorpholin-4-ium IUPAC Name: 4-[(R)-[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]-thiophen-2-ylmethyl]thiomorpholin-4-ium Traditional Name: 4-[(R)-(1-p-anisyltetrazol-5-yl)-(2-thienyl)methyl]thiomorpholin-4-ium Formula: C18H22N5OS2+ MolecularWeight: 388.53018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=NN=N2)C(C3=CC=CS3)[NH+]4CCSCC4

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=NN=N2)[C@H](C3=CC=CS3)[NH+]4CCSCC4

InChI

InChI=1S/C18H21N5OS2/c1-24-15-6-4-14(5-7-15)13-23-18(19-20-21-23)17(16-3-2-10-26-16)22-8-11-25-12-9-22/h2-7,10,17H,8-9,11-13H2,1H3/p+1/t17-/m0/s1