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

Systemtic Name: 3-[4-ethoxy-1-(phenylmethyl)pyrrol-2-yl]-2,3-dimethyl-butane-2-thiol Openeye Name: 3-(1-benzyl-4-ethoxy-pyrrol-2-yl)-2,3-dimethyl-butane-2-thiol CAS Name: 3-[4-ethoxy-1-(phenylmethyl)-2-pyrrolyl]-2,3-dimethyl-2-butanethiol IUPAC Name: 3-(1-benzyl-4-ethoxypyrrol-2-yl)-2,3-dimethylbutane-2-thiol Traditional Name: 3-(1-benzyl-4-ethoxy-pyrrol-2-yl)-2,3-dimethyl-butane-2-thiol Formula: C19H27NOS MolecularWeight: 317.48878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(C(=C1)C(C)(C)C(C)(C)S)CC2=CC=CC=C2

Isomeric SMILES

CCOC1=CN(C(=C1)C(C)(C)C(C)(C)S)CC2=CC=CC=C2

InChI

InChI=1S/C19H27NOS/c1-6-21-16-12-17(18(2,3)19(4,5)22)20(14-16)13-15-10-8-7-9-11-15/h7-12,14,22H,6,13H2,1-5H3