N-carbamimidoyl-4-chloranyl-1-methyl-N-[2-[methyl-(phenylmethyl)amino]ethoxy]indole-2-carboxamide

Systemtic Name: N-carbamimidoyl-4-chloranyl-1-methyl-N-[2-[methyl-(phenylmethyl)amino]ethoxy]indole-2-carboxamide Openeye Name: N-[2-[benzyl(methyl)amino]ethoxy]-N-carbamimidoyl-4-chloro-1-methyl-indole-2-carboxamide CAS Name: N-carbamimidoyl-4-chloro-1-methyl-N-[2-[methyl-(phenylmethyl)amino]ethoxy]-2-indolecarboxamide IUPAC Name: N-[2-[benzyl(methyl)amino]ethoxy]-N-carbamimidoyl-4-chloro-1-methylindole-2-carboxamide Traditional Name: N-amidino-N-[2-[benzyl(methyl)amino]ethoxy]-4-chloro-1-methyl-indole-2-carboxamide Formula: C21H24ClN5O2 MolecularWeight: 413.90056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C1C(=O)N(C(=N)N)OCCN(C)CC3=CC=CC=C3)C(=CC=C2)Cl

Isomeric SMILES

CN1C2=C(C=C1C(=O)N(C(=N)N)OCCN(C)CC3=CC=CC=C3)C(=CC=C2)Cl

InChI

InChI=1S/C21H24ClN5O2/c1-25(14-15-7-4-3-5-8-15)11-12-29-27(21(23)24)20(28)19-13-16-17(22)9-6-10-18(16)26(19)2/h3-10,13H,11-12,14H2,1-2H3,(H3,23,24)