(2-tert-butyl-3-ethoxycarbonyl-6-methoxy-benzimidazol-5-yl)carbamodithioic acid

Systemtic Name: (2-tert-butyl-3-ethoxycarbonyl-6-methoxy-benzimidazol-5-yl)carbamodithioic acid Openeye Name: (2-tert-butyl-3-ethoxycarbonyl-6-methoxy-benzimidazol-5-yl)carbamodithioic acid CAS Name: (2-tert-butyl-3-ethoxycarbonyl-6-methoxy-5-benzimidazolyl)carbamodithioic acid IUPAC Name: (2-tert-butyl-3-ethoxycarbonyl-6-methoxybenzimidazol-5-yl)carbamodithioic acid Traditional Name: (2-tert-butyl-3-carbethoxy-6-methoxy-benzimidazol-5-yl)carbamodithioic acid Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC(=C(C=C2N=C1C(C)(C)C)OC)NC(=S)S

Isomeric SMILES

CCOC(=O)N1C2=CC(=C(C=C2N=C1C(C)(C)C)OC)NC(=S)S

InChI

InChI=1S/C16H21N3O3S2/c1-6-22-15(20)19-11-7-10(18-14(23)24)12(21-5)8-9(11)17-13(19)16(2,3)4/h7-8H,6H2,1-5H3,(H2,18,23,24)