5-[(2S)-1-[2-(3-cyano-2-methyl-indol-1-yl)ethanoyl]pyrrolidin-2-yl]thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-[2-(3-cyano-2-methyl-indol-1-yl)ethanoyl]pyrrolidin-2-yl]thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-[2-(3-cyano-2-methyl-indol-1-yl)acetyl]pyrrolidin-2-yl]thiophene-2-carboxamide CAS Name: 5-[(2S)-1-[2-(3-cyano-2-methyl-1-indolyl)-1-oxoethyl]-2-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-[2-(3-cyano-2-methylindol-1-yl)acetyl]pyrrolidin-2-yl]thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-[2-(3-cyano-2-methyl-indol-1-yl)acetyl]pyrrolidin-2-yl]thiophene-2-carboxamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC(=O)N3CCCC3C4=CC=C(S4)C(=O)N)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC(=O)N3CCC[C@H]3C4=CC=C(S4)C(=O)N)C#N

InChI

InChI=1S/C21H20N4O2S/c1-13-15(11-22)14-5-2-3-6-16(14)25(13)12-20(26)24-10-4-7-17(24)18-8-9-19(28-18)21(23)27/h2-3,5-6,8-9,17H,4,7,10,12H2,1H3,(H2,23,27)/t17-/m0/s1