2-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-5-nitro-1,3-benzothiazole

Systemtic Name: 2-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-5-nitro-1,3-benzothiazole Openeye Name: 2-[[2-(4-methoxyphenyl)thiazol-4-yl]methylsulfanyl]-5-nitro-1,3-benzothiazole CAS Name: 2-[[2-(4-methoxyphenyl)-4-thiazolyl]methylthio]-5-nitro-1,3-benzothiazole IUPAC Name: 2-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-5-nitro-1,3-benzothiazole Traditional Name: 2-[[2-(4-methoxyphenyl)thiazol-4-yl]methylthio]-5-nitro-1,3-benzothiazole Formula: C18H13N3O3S3 MolecularWeight: 415.50912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O3S3/c1-24-14-5-2-11(3-6-14)17-19-12(9-25-17)10-26-18-20-15-8-13(21(22)23)4-7-16(15)27-18/h2-9H,10H2,1H3