1-[[[2-[(4-tert-butylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylidene]naphthalen-2-one

Systemtic Name: 1-[[[2-[(4-tert-butylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylidene]naphthalen-2-one Openeye Name: 1-[[[2-[(4-tert-butylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylene]naphthalen-2-one CAS Name: 1-[[[2-[(4-tert-butylphenyl)methylthio]-1,3-benzothiazol-6-yl]amino]methylidene]-2-naphthalenone IUPAC Name: 1-[[[2-[(4-tert-butylphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylidene]naphthalen-2-one Traditional Name: 1-[[[2-[(4-tert-butylbenzyl)thio]-1,3-benzothiazol-6-yl]amino]methylene]naphthalen-2-one Formula: C29H26N2OS2 MolecularWeight: 482.65954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)NC=C4C(=O)C=CC5=CC=CC=C54

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)NC=C4C(=O)C=CC5=CC=CC=C54

InChI

InChI=1S/C29H26N2OS2/c1-29(2,3)21-11-8-19(9-12-21)18-33-28-31-25-14-13-22(16-27(25)34-28)30-17-24-23-7-5-4-6-20(23)10-15-26(24)32/h4-17,30H,18H2,1-3H3