(6E)-2-tert-butyl-6-[[[(2S)-2-[[(E)-(5-tert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-4-methylsulfanyl-butyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-tert-butyl-6-[[[(2S)-2-[[(E)-(5-tert-butyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-4-methylsulfanyl-butyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-tert-butyl-6-[[[(2S)-2-[[(E)-(5-tert-butyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-4-methylsulfanyl-butyl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-tert-butyl-6-[[[(2S)-2-[[(E)-(5-tert-butyl-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]-4-(methylthio)butyl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2-tert-butyl-6-[[[(2S)-2-[[(E)-(5-tert-butyl-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-4-methylsulfanylbutyl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-tert-butyl-6-[[[(2S)-2-[[(E)-(5-tert-butyl-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]-4-(methylthio)butyl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C27H38N2O2S MolecularWeight: 454.66782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=CNCC(CCSC)NC=C2C=CC=C(C2=O)C(C)(C)C)C1=O

Isomeric SMILES

CC(C)(C)C1=CC=C/C(=C\NC[C@H](CCSC)N/C=C/2\C=CC=C(C2=O)C(C)(C)C)/C1=O

InChI

InChI=1S/C27H38N2O2S/c1-26(2,3)22-12-8-10-19(24(22)30)16-28-18-21(14-15-32-7)29-17-20-11-9-13-23(25(20)31)27(4,5)6/h8-13,16-17,21,28-29H,14-15,18H2,1-7H3/b19-16+,20-17+/t21-/m0/s1