(2-tert-butyl-6-propylsulfanyl-3H-benzimidazol-5-yl)carbamodithioic acid

Systemtic Name: (2-tert-butyl-6-propylsulfanyl-3H-benzimidazol-5-yl)carbamodithioic acid Openeye Name: (2-tert-butyl-6-propylsulfanyl-3H-benzimidazol-5-yl)carbamodithioic acid CAS Name: [2-tert-butyl-6-(propylthio)-3H-benzimidazol-5-yl]carbamodithioic acid IUPAC Name: (2-tert-butyl-6-propylsulfanyl-3H-benzimidazol-5-yl)carbamodithioic acid Traditional Name: [2-tert-butyl-6-(propylthio)-3H-benzimidazol-5-yl]carbamodithioic acid Formula: C15H21N3S3 MolecularWeight: 339.54234

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=C2C(=C1)N=C(N2)C(C)(C)C)NC(=S)S

Isomeric SMILES

CCCSC1=C(C=C2C(=C1)N=C(N2)C(C)(C)C)NC(=S)S

InChI

InChI=1S/C15H21N3S3/c1-5-6-21-12-8-10-9(7-11(12)18-14(19)20)16-13(17-10)15(2,3)4/h7-8H,5-6H2,1-4H3,(H,16,17)(H2,18,19,20)