3-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-N-methyl-N-pyrrolidin-2-yl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-N-methyl-N-pyrrolidin-2-yl-1-benzothiophene-2-carboxamide Openeye Name: 3-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-N-methyl-N-pyrrolidin-2-yl-benzothiophene-2-carboxamide CAS Name: 3-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-N-methyl-N-(2-pyrrolidinyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]-N-methyl-N-pyrrolidin-2-yl-1-benzothiophene-2-carboxamide Traditional Name: 3-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]-N-methyl-N-pyrrolidin-2-yl-benzothiophene-2-carboxamide Formula: C27H31N5OS MolecularWeight: 473.63294

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3=C(SC4=CC=CC=C43)C(=O)N(C)C5CCCN5

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3=C(SC4=CC=CC=C43)C(=O)N(C)C5CCCN5

InChI

InChI=1S/C27H31N5OS/c1-3-32-19(15-17-10-11-18(26(28)29)16-22(17)32)12-13-21-20-7-4-5-8-23(20)34-25(21)27(33)31(2)24-9-6-14-30-24/h4-5,7-8,10-11,15-16,24,30H,3,6,9,12-14H2,1-2H3,(H3,28,29)