6-[(5-carbamimidoyl-1-benzothiophen-2-yl)carbonylamino]hexanoic acid

Systemtic Name: 6-[(5-carbamimidoyl-1-benzothiophen-2-yl)carbonylamino]hexanoic acid Openeye Name: 6-[(5-carbamimidoylbenzothiophene-2-carbonyl)amino]hexanoic acid CAS Name: 6-[[(5-carbamimidoyl-1-benzothiophen-2-yl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(5-carbamimidoyl-1-benzothiophene-2-carbonyl)amino]hexanoic acid Traditional Name: 6-[(5-amidinobenzothiophene-2-carbonyl)amino]hexanoic acid Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=N)N)C=C(S2)C(=O)NCCCCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(=N)N)C=C(S2)C(=O)NCCCCCC(=O)O

InChI

InChI=1S/C16H19N3O3S/c17-15(18)10-5-6-12-11(8-10)9-13(23-12)16(22)19-7-3-1-2-4-14(20)21/h5-6,8-9H,1-4,7H2,(H3,17,18)(H,19,22)(H,20,21)