2-[[6-(anthracen-9-ylmethylideneamino)-1,3-benzothiazol-2-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[[6-(anthracen-9-ylmethylideneamino)-1,3-benzothiazol-2-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[[6-(9-anthrylmethyleneamino)-1,3-benzothiazol-2-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[6-(9-anthracenylmethylideneamino)-1,3-benzothiazol-2-yl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[[6-(anthracen-9-ylmethylideneamino)-1,3-benzothiazol-2-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[6-(9-anthrylmethyleneamino)-1,3-benzothiazol-2-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C31H23N3O2S2 MolecularWeight: 533.66322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C31H23N3O2S2/c1-36-24-13-10-22(11-14-24)33-30(35)19-37-31-34-28-15-12-23(17-29(28)38-31)32-18-27-25-8-4-2-6-20(25)16-21-7-3-5-9-26(21)27/h2-18H,19H2,1H3,(H,33,35)