2-[[6-[(4-iodophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: 2-[[6-[(4-iodophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-[[6-[(4-iodophenyl)methyleneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[[6-[(4-iodophenyl)methylideneamino]-1,3-benzothiazol-2-yl]thio]-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-[[6-[(4-iodophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[[6-[(4-iodobenzylidene)amino]-1,3-benzothiazol-2-yl]thio]-N-(tetrahydrofurfuryl)acetamide Formula: C21H20IN3O2S2 MolecularWeight: 537.43687

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC=C(C=C4)I

Isomeric SMILES

C1CC(OC1)CNC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC=C(C=C4)I

InChI

InChI=1S/C21H20IN3O2S2/c22-15-5-3-14(4-6-15)11-23-16-7-8-18-19(10-16)29-21(25-18)28-13-20(26)24-12-17-2-1-9-27-17/h3-8,10-11,17H,1-2,9,12-13H2,(H,24,26)