N-[[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]phenyl]-5-oxo-pyrrolidin-3-yl]methyl]benzothiophene-2-carboxamide CAS Name: N-[[1-[4-[2-(dimethylaminomethyl)-1-imidazolyl]phenyl]-5-oxo-3-pyrrolidinyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]phenyl]-5-oxopyrrolidin-3-yl]methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[[1-[4-[2-(dimethylaminomethyl)imidazol-1-yl]phenyl]-5-keto-pyrrolidin-3-yl]methyl]benzothiophene-2-carboxamide Formula: C26H27N5O2S MolecularWeight: 473.58988

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC=CN1C2=CC=C(C=C2)N3CC(CC3=O)CNC(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

CN(C)CC1=NC=CN1C2=CC=C(C=C2)N3CC(CC3=O)CNC(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C26H27N5O2S/c1-29(2)17-24-27-11-12-30(24)20-7-9-21(10-8-20)31-16-18(13-25(31)32)15-28-26(33)23-14-19-5-3-4-6-22(19)34-23/h3-12,14,18H,13,15-17H2,1-2H3,(H,28,33)