4-(3H-1,3-benzothiazol-2-ylidene)-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(3H-1,3-benzothiazol-2-ylidene)-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-(3H-1,3-benzothiazol-2-ylidene)-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one CAS Name: 4-(3H-1,3-benzothiazol-2-ylidene)-2,6-ditert-butyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-(3H-1,3-benzothiazol-2-ylidene)-2,6-ditert-butylcyclohexa-2,5-dien-1-one Traditional Name: 4-(3H-1,3-benzothiazol-2-ylidene)-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Formula: C21H25NOS MolecularWeight: 339.4943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2NC3=CC=CC=C3S2)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2NC3=CC=CC=C3S2)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C21H25NOS/c1-20(2,3)14-11-13(12-15(18(14)23)21(4,5)6)19-22-16-9-7-8-10-17(16)24-19/h7-12,22H,1-6H3