2-[6-(4-chlorophenyl)-3-isocyano-hexan-3-yl]thiophene

Systemtic Name: 2-[6-(4-chlorophenyl)-3-isocyano-hexan-3-yl]thiophene Openeye Name: 2-[4-(4-chlorophenyl)-1-ethyl-1-isocyano-butyl]thiophene CAS Name: 2-[6-(4-chlorophenyl)-3-isocyanohexan-3-yl]thiophene IUPAC Name: 2-[6-(4-chlorophenyl)-3-isocyanohexan-3-yl]thiophene Traditional Name: 2-[4-(4-chlorophenyl)-1-ethyl-1-isocyano-butyl]thiophene Formula: C17H18ClNS MolecularWeight: 303.84952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCC1=CC=C(C=C1)Cl)(C2=CC=CS2)[N+]#[C-]

Isomeric SMILES

CCC(CCCC1=CC=C(C=C1)Cl)(C2=CC=CS2)[N+]#[C-]

InChI

InChI=1S/C17H18ClNS/c1-3-17(19-2,16-7-5-13-20-16)12-4-6-14-8-10-15(18)11-9-14/h5,7-11,13H,3-4,6,12H2,1H3