3-methoxy-2-[2-[1-(2-phenylethanoyl)pyrrolidin-2-yl]ethyl]-1-benzothiophene-6-carboximidamide

Systemtic Name: 3-methoxy-2-[2-[1-(2-phenylethanoyl)pyrrolidin-2-yl]ethyl]-1-benzothiophene-6-carboximidamide Openeye Name: 3-methoxy-2-[2-[1-(2-phenylacetyl)pyrrolidin-2-yl]ethyl]benzothiophene-6-carboxamidine CAS Name: 3-methoxy-2-[2-[1-(1-oxo-2-phenylethyl)-2-pyrrolidinyl]ethyl]-1-benzothiophene-6-carboximidamide IUPAC Name: 3-methoxy-2-[2-[1-(2-phenylacetyl)pyrrolidin-2-yl]ethyl]-1-benzothiophene-6-carboximidamide Traditional Name: 3-methoxy-2-[2-[1-(2-phenylacetyl)pyrrolidin-2-yl]ethyl]benzothiophene-6-carboxamidine Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC2=C1C=CC(=C2)C(=N)N)CCC3CCCN3C(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(SC2=C1C=CC(=C2)C(=N)N)CCC3CCCN3C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O2S/c1-29-23-19-11-9-17(24(25)26)15-21(19)30-20(23)12-10-18-8-5-13-27(18)22(28)14-16-6-3-2-4-7-16/h2-4,6-7,9,11,15,18H,5,8,10,12-14H2,1H3,(H3,25,26)