[2-tert-butyl-6-methoxy-3-(phenylmethyl)benzimidazol-5-yl]carbamodithioic acid

Systemtic Name: [2-tert-butyl-6-methoxy-3-(phenylmethyl)benzimidazol-5-yl]carbamodithioic acid Openeye Name: (3-benzyl-2-tert-butyl-6-methoxy-benzimidazol-5-yl)carbamodithioic acid CAS Name: [2-tert-butyl-6-methoxy-3-(phenylmethyl)-5-benzimidazolyl]carbamodithioic acid IUPAC Name: (3-benzyl-2-tert-butyl-6-methoxybenzimidazol-5-yl)carbamodithioic acid Traditional Name: (3-benzyl-2-tert-butyl-6-methoxy-benzimidazol-5-yl)carbamodithioic acid Formula: C20H23N3OS2 MolecularWeight: 385.54612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC(=C(C=C2N1CC3=CC=CC=C3)NC(=S)S)OC

Isomeric SMILES

CC(C)(C)C1=NC2=CC(=C(C=C2N1CC3=CC=CC=C3)NC(=S)S)OC

InChI

InChI=1S/C20H23N3OS2/c1-20(2,3)18-21-14-11-17(24-4)15(22-19(25)26)10-16(14)23(18)12-13-8-6-5-7-9-13/h5-11H,12H2,1-4H3,(H2,22,25,26)