4-(3-bromanylthiophen-1-ium-2-ylidene)-2,6-ditert-butyl-thiopyran

Systemtic Name: 4-(3-bromanylthiophen-1-ium-2-ylidene)-2,6-ditert-butyl-thiopyran Openeye Name: 4-(3-bromothiophen-1-ium-2-ylidene)-2,6-ditert-butyl-thiopyran CAS Name: 4-(3-bromo-2-thiophen-1-iumylidene)-2,6-ditert-butylthiopyran IUPAC Name: 4-(3-bromothiophen-1-ium-2-ylidene)-2,6-ditert-butylthiopyran Traditional Name: 4-(3-bromothiophen-1-ium-2-ylidene)-2,6-ditert-butyl-thiopyran Formula: C17H22BrS2+ MolecularWeight: 370.39058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=CC=[S+]2)Br)C=C(S1)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=CC=[S+]2)Br)C=C(S1)C(C)(C)C

InChI

InChI=1S/C17H22BrS2/c1-16(2,3)13-9-11(15-12(18)7-8-19-15)10-14(20-13)17(4,5)6/h7-10H,1-6H3/q+1