4-tert-butyl-5-[(E,3Z)-3-(4-tert-butyl-2-pyrrolidin-1-ium-1-ylidene-1,3-thiazol-5-ylidene)prop-1-enyl]-2-pyrrolidin-1-yl-1,3-thiazole bromide

Systemtic Name: 4-tert-butyl-5-[(E,3Z)-3-(4-tert-butyl-2-pyrrolidin-1-ium-1-ylidene-1,3-thiazol-5-ylidene)prop-1-enyl]-2-pyrrolidin-1-yl-1,3-thiazole bromide Openeye Name: 4-tert-butyl-5-[(E,3Z)-3-(4-tert-butyl-2-pyrrolidin-1-ium-1-ylidene-thiazol-5-ylidene)prop-1-enyl]-2-pyrrolidin-1-yl-thiazole bromide CAS Name: 4-tert-butyl-5-[(E,3Z)-3-[4-tert-butyl-2-(1-pyrrolidin-1-iumylidene)-5-thiazolylidene]prop-1-enyl]-2-(1-pyrrolidinyl)thiazole bromide IUPAC Name: 4-tert-butyl-5-[(E,3Z)-3-(4-tert-butyl-2-pyrrolidin-1-ium-1-ylidene-1,3-thiazol-5-ylidene)prop-1-enyl]-2-pyrrolidin-1-yl-1,3-thiazole bromide Traditional Name: 4-tert-butyl-5-[(E,3Z)-3-(4-tert-butyl-2-pyrrolidin-1-ium-1-ylidene-3-thiazolin-5-ylidene)prop-1-enyl]-2-pyrrolidino-thiazole bromide Formula: C25H37BrN4S2 MolecularWeight: 537.62208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=N1)N2CCCC2)C=CC=C3C(=NC(=[N+]4CCCC4)S3)C(C)(C)C.[Br-]

Isomeric SMILES

CC(C)(C)C1=C(SC(=N1)N2CCCC2)/C=C/C=C\3/C(=NC(=[N+]4CCCC4)S3)C(C)(C)C.[Br-]

InChI

InChI=1S/C25H37N4S2.BrH/c1-24(2,3)20-18(30-22(26-20)28-14-7-8-15-28)12-11-13-19-21(25(4,5)6)27-23(31-19)29-16-9-10-17-29;/h11-13H,7-10,14-17H2,1-6H3;1H/q+1;/p-1