2-[4-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-[methyl(3-thienylmethyl)amino]-2-oxo-ethyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[2-[methyl(3-thiophenylmethyl)amino]-2-oxoethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[2-[methyl(thiophen-3-ylmethyl)amino]-2-oxoethyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[2-keto-2-[methyl(3-thenyl)amino]ethyl]piperazino]acetic acid Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C(=O)CN2CCN(CC2)CC(=O)O

Isomeric SMILES

CN(CC1=CSC=C1)C(=O)CN2CCN(CC2)CC(=O)O

InChI

InChI=1S/C14H21N3O3S/c1-15(8-12-2-7-21-11-12)13(18)9-16-3-5-17(6-4-16)10-14(19)20/h2,7,11H,3-6,8-10H2,1H3,(H,19,20)