(2S)-1-[(2S)-2-azanyl-3-(1-methylindol-3-yl)propanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: (2S)-1-[(2S)-2-azanyl-3-(1-methylindol-3-yl)propanoyl]pyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[(2S)-2-amino-3-(1-methylindol-3-yl)propanoyl]pyrrolidine-2-carbonitrile CAS Name: (2S)-1-[(2S)-2-amino-3-(1-methyl-3-indolyl)-1-oxopropyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-1-[(2S)-2-amino-3-(1-methylindol-3-yl)propanoyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[(2S)-2-amino-3-(1-methylindol-3-yl)propanoyl]pyrrolidine-2-carbonitrile Formula: C17H20N4O MolecularWeight: 296.3669

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC(C(=O)N3CCCC3C#N)N

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C[C@@H](C(=O)N3CCC[C@H]3C#N)N

InChI

InChI=1S/C17H20N4O/c1-20-11-12(14-6-2-3-7-16(14)20)9-15(19)17(22)21-8-4-5-13(21)10-18/h2-3,6-7,11,13,15H,4-5,8-9,19H2,1H3/t13-,15-/m0/s1