methyl N-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethyl]carbamate

Systemtic Name: methyl N-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethyl]carbamate Openeye Name: methyl N-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethyl]carbamate CAS Name: N-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[6-carbamimidoyl-2-(4-carbamimidoylphenyl)-1H-indol-3-yl]ethyl]carbamate Traditional Name: N-[2-[6-amidino-2-(4-amidinophenyl)-1H-indol-3-yl]ethyl]carbamic acid methyl ester Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NCCC1=C(NC2=C1C=CC(=C2)C(=N)N)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)NCCC1=C(NC2=C1C=CC(=C2)C(=N)N)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H22N6O2/c1-28-20(27)25-9-8-15-14-7-6-13(19(23)24)10-16(14)26-17(15)11-2-4-12(5-3-11)18(21)22/h2-7,10,26H,8-9H2,1H3,(H3,21,22)(H3,23,24)(H,25,27)