1-methyl-2-[2-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)ethyl]indole-6-carboximidamide

Systemtic Name: 1-methyl-2-[2-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)ethyl]indole-6-carboximidamide Openeye Name: 1-methyl-2-[2-[1-(2-naphthylsulfonyl)pyrrolidin-2-yl]ethyl]indole-6-carboxamidine CAS Name: 1-methyl-2-[2-[1-(2-naphthalenylsulfonyl)-2-pyrrolidinyl]ethyl]-6-indolecarboximidamide IUPAC Name: 1-methyl-2-[2-(1-naphthalen-2-ylsulfonylpyrrolidin-2-yl)ethyl]indole-6-carboximidamide Traditional Name: 1-methyl-2-[2-[1-(2-naphthylsulfonyl)pyrrolidin-2-yl]ethyl]indole-6-carboxamidine Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H28N4O2S/c1-29-23(15-20-8-9-21(26(27)28)17-25(20)29)12-11-22-7-4-14-30(22)33(31,32)24-13-10-18-5-2-3-6-19(18)16-24/h2-3,5-6,8-10,13,15-17,22H,4,7,11-12,14H2,1H3,(H3,27,28)