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

Systemtic Name: 2-[[6-(anthracen-9-ylmethylideneamino)-1,3-benzothiazol-2-yl]sulfanyl]-N-(4-butoxyphenyl)ethanamide Openeye Name: 2-[[6-(9-anthrylmethyleneamino)-1,3-benzothiazol-2-yl]sulfanyl]-N-(4-butoxyphenyl)acetamide CAS Name: 2-[[6-(9-anthracenylmethylideneamino)-1,3-benzothiazol-2-yl]thio]-N-(4-butoxyphenyl)acetamide IUPAC Name: 2-[[6-(anthracen-9-ylmethylideneamino)-1,3-benzothiazol-2-yl]sulfanyl]-N-(4-butoxyphenyl)acetamide Traditional Name: 2-[[6-(9-anthrylmethyleneamino)-1,3-benzothiazol-2-yl]thio]-N-(4-butoxyphenyl)acetamide Formula: C34H29N3O2S2 MolecularWeight: 575.74296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=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

CCCCOC1=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/C34H29N3O2S2/c1-2-3-18-39-27-15-12-25(13-16-27)36-33(38)22-40-34-37-31-17-14-26(20-32(31)41-34)35-21-30-28-10-6-4-8-23(28)19-24-9-5-7-11-29(24)30/h4-17,19-21H,2-3,18,22H2,1H3,(H,36,38)