2-[[6-[(3-nitro-4-pyridin-2-ylsulfanyl-phenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[6-[(3-nitro-4-pyridin-2-ylsulfanyl-phenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[6-[[3-nitro-4-(2-pyridylsulfanyl)phenyl]methyleneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[6-[[3-nitro-4-(2-pyridinylthio)phenyl]methylideneamino]-1,3-benzothiazol-2-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[6-[(3-nitro-4-pyridin-2-ylsulfanylphenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[6-[[3-nitro-4-(2-pyridylthio)benzylidene]amino]-1,3-benzothiazol-2-yl]thio]-N-phenethyl-acetamide Formula: C29H23N5O3S3 MolecularWeight: 585.71962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC(=C(C=C4)SC5=CC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC(=C(C=C4)SC5=CC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C29H23N5O3S3/c35-27(30-15-13-20-6-2-1-3-7-20)19-38-29-33-23-11-10-22(17-26(23)40-29)32-18-21-9-12-25(24(16-21)34(36)37)39-28-8-4-5-14-31-28/h1-12,14,16-18H,13,15,19H2,(H,30,35)