3-(4-ethoxy-5-ethyl-1-phenyl-pyrrol-2-yl)-2,3-dimethyl-butane-2-thiol

Systemtic Name: 3-(4-ethoxy-5-ethyl-1-phenyl-pyrrol-2-yl)-2,3-dimethyl-butane-2-thiol Openeye Name: 3-(4-ethoxy-5-ethyl-1-phenyl-pyrrol-2-yl)-2,3-dimethyl-butane-2-thiol CAS Name: 3-(4-ethoxy-5-ethyl-1-phenyl-2-pyrrolyl)-2,3-dimethyl-2-butanethiol IUPAC Name: 3-(4-ethoxy-5-ethyl-1-phenylpyrrol-2-yl)-2,3-dimethylbutane-2-thiol Traditional Name: 3-(4-ethoxy-5-ethyl-1-phenyl-pyrrol-2-yl)-2,3-dimethyl-butane-2-thiol Formula: C20H29NOS MolecularWeight: 331.51536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(N1C2=CC=CC=C2)C(C)(C)C(C)(C)S)OCC

Isomeric SMILES

CCC1=C(C=C(N1C2=CC=CC=C2)C(C)(C)C(C)(C)S)OCC

InChI

InChI=1S/C20H29NOS/c1-7-16-17(22-8-2)14-18(19(3,4)20(5,6)23)21(16)15-12-10-9-11-13-15/h9-14,23H,7-8H2,1-6H3