2-[2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[(6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-oxomethyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[(6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)amino]acetyl]amino]acetic acid Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)NCC(=O)NCC(=O)O

Isomeric SMILES

CC1CCC2=C(C1)SC=C2C(=O)NCC(=O)NCC(=O)O

InChI

InChI=1S/C14H18N2O4S/c1-8-2-3-9-10(7-21-11(9)4-8)14(20)16-5-12(17)15-6-13(18)19/h7-8H,2-6H2,1H3,(H,15,17)(H,16,20)(H,18,19)