4-[[(3S)-3-acetamidopyrrolidin-1-yl]methyl]-N-(2-azanyl-5-thiophen-2-yl-phenyl)benzamide

Systemtic Name: 4-[[(3S)-3-acetamidopyrrolidin-1-yl]methyl]-N-(2-azanyl-5-thiophen-2-yl-phenyl)benzamide Openeye Name: 4-[[(3S)-3-acetamidopyrrolidin-1-yl]methyl]-N-[2-amino-5-(2-thienyl)phenyl]benzamide CAS Name: 4-[[(3S)-3-acetamido-1-pyrrolidinyl]methyl]-N-(2-amino-5-thiophen-2-ylphenyl)benzamide IUPAC Name: 4-[[(3S)-3-acetamidopyrrolidin-1-yl]methyl]-N-(2-amino-5-thiophen-2-ylphenyl)benzamide Traditional Name: 4-[[(3S)-3-acetamidopyrrolidino]methyl]-N-[2-amino-5-(2-thienyl)phenyl]benzamide Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCN(C1)CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N

Isomeric SMILES

CC(=O)N[C@H]1CCN(C1)CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N

InChI

InChI=1S/C24H26N4O2S/c1-16(29)26-20-10-11-28(15-20)14-17-4-6-18(7-5-17)24(30)27-22-13-19(8-9-21(22)25)23-3-2-12-31-23/h2-9,12-13,20H,10-11,14-15,25H2,1H3,(H,26,29)(H,27,30)/t20-/m0/s1