1-ethyl-2-[2-[1-[1-(3-sulfanylpropanoyl)pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]ethyl]indole-6-carboximidamide

Systemtic Name: 1-ethyl-2-[2-[1-[1-(3-sulfanylpropanoyl)pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]ethyl]indole-6-carboximidamide Openeye Name: 1-ethyl-2-[2-[1-[1-(3-sulfanylpropanoyl)pyrrolidine-2-carbonyl]pyrrolidin-2-yl]ethyl]indole-6-carboxamidine CAS Name: 1-ethyl-2-[2-[1-[[1-(3-mercapto-1-oxopropyl)-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinyl]ethyl]-6-indolecarboximidamide IUPAC Name: 1-ethyl-2-[2-[1-[1-(3-sulfanylpropanoyl)pyrrolidine-2-carbonyl]pyrrolidin-2-yl]ethyl]indole-6-carboximidamide Traditional Name: 1-ethyl-2-[2-[1-[1-(3-mercaptopropanoyl)prolyl]pyrrolidin-2-yl]ethyl]indole-6-carboxamidine Formula: C25H35N5O2S MolecularWeight: 469.6427

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C4CCCN4C(=O)CCS

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C4CCCN4C(=O)CCS

InChI

InChI=1S/C25H35N5O2S/c1-2-28-20(15-17-7-8-18(24(26)27)16-22(17)28)10-9-19-5-3-12-29(19)25(32)21-6-4-13-30(21)23(31)11-14-33/h7-8,15-16,19,21,33H,2-6,9-14H2,1H3,(H3,26,27)