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

Systemtic Name: 2-[[6-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-[[6-[(3-nitrophenyl)methyleneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[[6-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazol-2-yl]thio]-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-[[6-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[[6-[(3-nitrobenzylidene)amino]-1,3-benzothiazol-2-yl]thio]-N-(tetrahydrofurfuryl)acetamide Formula: C21H20N4O4S2 MolecularWeight: 456.5379

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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(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4S2/c26-20(23-12-17-5-2-8-29-17)13-30-21-24-18-7-6-15(10-19(18)31-21)22-11-14-3-1-4-16(9-14)25(27)28/h1,3-4,6-7,9-11,17H,2,5,8,12-13H2,(H,23,26)