2-[[2-[(4-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]methylsulfonyl]-1,3-benzothiazole

Systemtic Name: 2-[[2-[(4-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]methylsulfonyl]-1,3-benzothiazole Openeye Name: 2-[[2-[(4-chlorophenoxy)methyl]thiazol-4-yl]methylsulfonyl]-1,3-benzothiazole CAS Name: 2-[[2-[(4-chlorophenoxy)methyl]-4-thiazolyl]methylsulfonyl]-1,3-benzothiazole IUPAC Name: 2-[[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-4-yl]methylsulfonyl]-1,3-benzothiazole Traditional Name: 2-[[2-[(4-chlorophenoxy)methyl]thiazol-4-yl]methylsulfonyl]-1,3-benzothiazole Formula: C18H13ClN2O3S3 MolecularWeight: 436.95542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CC3=CSC(=N3)COC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CC3=CSC(=N3)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H13ClN2O3S3/c19-12-5-7-14(8-6-12)24-9-17-20-13(10-25-17)11-27(22,23)18-21-15-3-1-2-4-16(15)26-18/h1-8,10H,9,11H2