3-[1-(4-chlorophenyl)-4-ethoxy-pyrrol-2-yl]-2,3-dimethyl-butane-2-thiol

Systemtic Name: 3-[1-(4-chlorophenyl)-4-ethoxy-pyrrol-2-yl]-2,3-dimethyl-butane-2-thiol Openeye Name: 3-[1-(4-chlorophenyl)-4-ethoxy-pyrrol-2-yl]-2,3-dimethyl-butane-2-thiol CAS Name: 3-[1-(4-chlorophenyl)-4-ethoxy-2-pyrrolyl]-2,3-dimethyl-2-butanethiol IUPAC Name: 3-[1-(4-chlorophenyl)-4-ethoxypyrrol-2-yl]-2,3-dimethylbutane-2-thiol Traditional Name: 3-[1-(4-chlorophenyl)-4-ethoxy-pyrrol-2-yl]-2,3-dimethyl-butane-2-thiol Formula: C18H24ClNOS MolecularWeight: 337.90726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(C(=C1)C(C)(C)C(C)(C)S)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=CN(C(=C1)C(C)(C)C(C)(C)S)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H24ClNOS/c1-6-21-15-11-16(17(2,3)18(4,5)22)20(12-15)14-9-7-13(19)8-10-14/h7-12,22H,6H2,1-5H3