2-[5-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-4-phenyl-1,2,4-triazol-3-yl]-1,3-thiazolidine-3-carbaldehyde

Systemtic Name: 2-[5-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-4-phenyl-1,2,4-triazol-3-yl]-1,3-thiazolidine-3-carbaldehyde Openeye Name: 2-[5-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-4-phenyl-1,2,4-triazol-3-yl]thiazolidine-3-carbaldehyde CAS Name: 2-[5-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)thio]-4-phenyl-1,2,4-triazol-3-yl]-3-thiazolidinecarboxaldehyde IUPAC Name: 2-[5-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-4-phenyl-1,2,4-triazol-3-yl]-1,3-thiazolidine-3-carbaldehyde Traditional Name: 2-[5-[(6-mesyl-1,3-benzothiazol-2-yl)thio]-4-phenyl-1,2,4-triazol-3-yl]thiazolidine-3-carbaldehyde Formula: C20H17N5O3S4 MolecularWeight: 503.64068

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SC3=NN=C(N3C4=CC=CC=C4)C5N(CCS5)C=O

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)SC3=NN=C(N3C4=CC=CC=C4)C5N(CCS5)C=O

InChI

InChI=1S/C20H17N5O3S4/c1-32(27,28)14-7-8-15-16(11-14)30-20(21-15)31-19-23-22-17(18-24(12-26)9-10-29-18)25(19)13-5-3-2-4-6-13/h2-8,11-12,18H,9-10H2,1H3