3-[(2Z)-2-[(2E)-2-[(3-ethyl-5,6-dimethyl-5H-telluropyrano[2,3-d][1,3]thiazol-3-ium-2-yl)methylidene]butylidene]-5,6-dimethoxy-1,3-benzothiazol-3-yl]propane-1-sulfonic acid

Systemtic Name: 3-[(2Z)-2-[(2E)-2-[(3-ethyl-5,6-dimethyl-5H-telluropyrano[2,3-d][1,3]thiazol-3-ium-2-yl)methylidene]butylidene]-5,6-dimethoxy-1,3-benzothiazol-3-yl]propane-1-sulfonic acid Openeye Name: 3-[(2Z)-2-[(2E)-2-[(3-ethyl-5,6-dimethyl-5H-telluropyrano[2,3-d]thiazol-3-ium-2-yl)methylene]butylidene]-5,6-dimethoxy-1,3-benzothiazol-3-yl]propane-1-sulfonic acid CAS Name: 3-[(2Z)-2-[(2E)-2-[(3-ethyl-5,6-dimethyl-5H-tellurino[2,3-d]thiazol-3-ium-2-yl)methylidene]butylidene]-5,6-dimethoxy-1,3-benzothiazol-3-yl]-1-propanesulfonic acid IUPAC Name: 3-[(2Z)-2-[(2E)-2-[(3-ethyl-5,6-dimethyl-5H-telluropyrano[2,3-d][1,3]thiazol-3-ium-2-yl)methylidene]butylidene]-5,6-dimethoxy-1,3-benzothiazol-3-yl]propane-1-sulfonic acid Traditional Name: 3-[(2Z)-2-[(E)-2-ethyl-3-(3-ethyl-5,6-dimethyl-5H-telluropyrano[2,3-d]thiazol-3-ium-2-yl)prop-2-enylidene]-5,6-dimethoxy-1,3-benzothiazol-3-yl]propane-1-sulfonic acid Formula: C27H35N2O5S3Te+ MolecularWeight: 691.3722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=[N+](C2=C(S1)C=C(C([Te]2)C)C)CC)C=C3N(C4=CC(=C(C=C4S3)OC)OC)CCCS(=O)(=O)O

Isomeric SMILES

CC/C(=C\C1=[N+](C2=C(S1)C=C(C([Te]2)C)C)CC)/C=C\3/N(C4=CC(=C(C=C4S3)OC)OC)CCCS(=O)(=O)O

InChI

InChI=1S/C27H34N2O5S3Te/c1-7-19(13-25-28(8-2)27-24(36-25)12-17(3)18(4)38-27)14-26-29(10-9-11-37(30,31)32)20-15-21(33-5)22(34-6)16-23(20)35-26/h12-16,18H,7-11H2,1-6H3/p+1