4-isothiocyanato-2,3-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene

Systemtic Name: 4-isothiocyanato-2,3-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene Openeye Name: 4-isothiocyanato-2,3-dimethyl-4,5,6,7-tetrahydrobenzothiophene CAS Name: 4-isothiocyanato-2,3-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene IUPAC Name: 4-isothiocyanato-2,3-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene Traditional Name: 4-isothiocyanato-2,3-dimethyl-4,5,6,7-tetrahydrobenzothiophene Formula: C11H13NS2 MolecularWeight: 223.35762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(CCC2)N=C=S)C

Isomeric SMILES

CC1=C(SC2=C1C(CCC2)N=C=S)C

InChI

InChI=1S/C11H13NS2/c1-7-8(2)14-10-5-3-4-9(11(7)10)12-6-13/h9H,3-5H2,1-2H3