tert-butyl 2-[4-[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]butanoylamino]ethanoate

Systemtic Name: tert-butyl 2-[4-[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]butanoylamino]ethanoate Openeye Name: tert-butyl 2-[4-[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]butanoylamino]acetate CAS Name: 2-[[4-[[(5-carbamimidoyl-1H-indol-2-yl)-oxomethyl]amino]-1-oxobutyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]butanoylamino]acetate Traditional Name: 2-[4-[(5-amidino-1H-indole-2-carbonyl)amino]butanoylamino]acetic acid tert-butyl ester Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNC(=O)CCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)CNC(=O)CCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=N)N

InChI

InChI=1S/C20H27N5O4/c1-20(2,3)29-17(27)11-24-16(26)5-4-8-23-19(28)15-10-13-9-12(18(21)22)6-7-14(13)25-15/h6-7,9-10,25H,4-5,8,11H2,1-3H3,(H3,21,22)(H,23,28)(H,24,26)