3-[[3-propan-2-yloxypropyl-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]amino]methyl]-1,3-benzothiazole-2-thione

Systemtic Name: 3-[[3-propan-2-yloxypropyl-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]amino]methyl]-1,3-benzothiazole-2-thione Openeye Name: 3-[[3-isopropoxypropyl-[(2-thioxo-1,3-benzothiazol-3-yl)methyl]amino]methyl]-1,3-benzothiazole-2-thione CAS Name: 3-[[3-propan-2-yloxypropyl-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]amino]methyl]-1,3-benzothiazole-2-thione IUPAC Name: 3-[[3-propan-2-yloxypropyl-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methyl]amino]methyl]-1,3-benzothiazole-2-thione Traditional Name: 3-[[3-isopropoxypropyl-[(2-thioxo-1,3-benzothiazol-3-yl)methyl]amino]methyl]-1,3-benzothiazole-2-thione Formula: C22H25N3OS4 MolecularWeight: 475.7134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN(CN1C2=CC=CC=C2SC1=S)CN3C4=CC=CC=C4SC3=S

Isomeric SMILES

CC(C)OCCCN(CN1C2=CC=CC=C2SC1=S)CN3C4=CC=CC=C4SC3=S

InChI

InChI=1S/C22H25N3OS4/c1-16(2)26-13-7-12-23(14-24-17-8-3-5-10-19(17)29-21(24)27)15-25-18-9-4-6-11-20(18)30-22(25)28/h3-6,8-11,16H,7,12-15H2,1-2H3