(6E)-2-(aminomethyl)-4-tert-butyl-6-[(4-methylphenyl)-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-(aminomethyl)-4-tert-butyl-6-[(4-methylphenyl)-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-(aminomethyl)-4-tert-butyl-6-[p-tolyl(sulfanyl)methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-(aminomethyl)-4-tert-butyl-6-[mercapto-(4-methylphenyl)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2-(aminomethyl)-4-tert-butyl-6-[(4-methylphenyl)-sulfanylmethylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-(aminomethyl)-4-tert-butyl-6-[mercapto(p-tolyl)methylene]cyclohexa-2,4-dien-1-one Formula: C19H23NOS MolecularWeight: 313.45702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=C2C=C(C=C(C2=O)CN)C(C)(C)C)S

Isomeric SMILES

CC1=CC=C(C=C1)/C(=C\2/C=C(C=C(C2=O)CN)C(C)(C)C)/S

InChI

InChI=1S/C19H23NOS/c1-12-5-7-13(8-6-12)18(22)16-10-15(19(2,3)4)9-14(11-20)17(16)21/h5-10,22H,11,20H2,1-4H3/b18-16+