3-azanyl-4-[(1E)-1-(2,6-ditert-butyl-3-sulfanyl-pyran-4-ylidene)ethyl]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-azanyl-4-[(1E)-1-(2,6-ditert-butyl-3-sulfanyl-pyran-4-ylidene)ethyl]cyclobut-3-ene-1,2-dione Openeye Name: 3-amino-4-[(1E)-1-(2,6-ditert-butyl-3-sulfanyl-pyran-4-ylidene)ethyl]cyclobut-3-ene-1,2-dione CAS Name: 3-amino-4-[(1E)-1-(2,6-ditert-butyl-3-mercapto-4-pyranylidene)ethyl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-amino-4-[(1E)-1-(2,6-ditert-butyl-3-sulfanylpyran-4-ylidene)ethyl]cyclobut-3-ene-1,2-dione Traditional Name: 3-amino-4-[(1E)-1-(2,6-ditert-butyl-3-mercapto-pyran-4-ylidene)ethyl]cyclobut-3-ene-1,2-quinone Formula: C19H25NO3S MolecularWeight: 347.4717

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=C(OC(=C1S)C(C)(C)C)C(C)(C)C)C2=C(C(=O)C2=O)N

Isomeric SMILES

C/C(=C\1/C=C(OC(=C1S)C(C)(C)C)C(C)(C)C)/C2=C(C(=O)C2=O)N

InChI

InChI=1S/C19H25NO3S/c1-9(12-13(20)15(22)14(12)21)10-8-11(18(2,3)4)23-17(16(10)24)19(5,6)7/h8,24H,20H2,1-7H3/b10-9+