ethyl 2-[4-[(6-carbamimidoyl-1-benzothiophen-2-yl)carbonylamino]cyclohexyl]oxyethanoate

Systemtic Name: ethyl 2-[4-[(6-carbamimidoyl-1-benzothiophen-2-yl)carbonylamino]cyclohexyl]oxyethanoate Openeye Name: ethyl 2-[4-[(6-carbamimidoylbenzothiophene-2-carbonyl)amino]cyclohexoxy]acetate CAS Name: 2-[4-[[(6-carbamimidoyl-1-benzothiophen-2-yl)-oxomethyl]amino]cyclohexyl]oxyacetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(6-carbamimidoyl-1-benzothiophene-2-carbonyl)amino]cyclohexyl]oxyacetate Traditional Name: 2-[4-[(6-amidinobenzothiophene-2-carbonyl)amino]cyclohexoxy]acetic acid ethyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1CCC(CC1)NC(=O)C2=CC3=C(S2)C=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)COC1CCC(CC1)NC(=O)C2=CC3=C(S2)C=C(C=C3)C(=N)N

InChI

InChI=1S/C20H25N3O4S/c1-2-26-18(24)11-27-15-7-5-14(6-8-15)23-20(25)17-9-12-3-4-13(19(21)22)10-16(12)28-17/h3-4,9-10,14-15H,2,5-8,11H2,1H3,(H3,21,22)(H,23,25)