ethyl 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-indol-5-yl]-propylsulfonyl-amino]ethanoate hydrochloride

Systemtic Name: ethyl 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-indol-5-yl]-propylsulfonyl-amino]ethanoate hydrochloride Openeye Name: ethyl 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-indol-5-yl]-propylsulfonyl-amino]acetate hydrochloride CAS Name: 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-methyl-5-indolyl]-propylsulfonylamino]acetic acid ethyl ester hydrochloride IUPAC Name: ethyl 2-[[2-[(4-carbamimidoylphenyl)methyl]-1-methylindol-5-yl]-propylsulfonylamino]acetate hydrochloride Traditional Name: 2-[[2-(4-amidinobenzyl)-1-methyl-indol-5-yl]-propylsulfonyl-amino]acetic acid ethyl ester hydrochloride Formula: C24H31ClN4O4S MolecularWeight: 507.04534

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(CC(=O)OCC)C1=CC2=C(C=C1)N(C(=C2)CC3=CC=C(C=C3)C(=N)N)C.Cl

Isomeric SMILES

CCCS(=O)(=O)N(CC(=O)OCC)C1=CC2=C(C=C1)N(C(=C2)CC3=CC=C(C=C3)C(=N)N)C.Cl

InChI

InChI=1S/C24H30N4O4S.ClH/c1-4-12-33(30,31)28(16-23(29)32-5-2)20-10-11-22-19(14-20)15-21(27(22)3)13-17-6-8-18(9-7-17)24(25)26;/h6-11,14-15H,4-5,12-13,16H2,1-3H3,(H3,25,26);1H