1-[(2S)-1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2S)-1-[(3-aminocarbonylthiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-[(3-carbamoyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2S)-1-[(3-carbamoyl-2-thiophenyl)amino]-1-oxopropan-2-yl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2S)-1-[(3-carbamoylthiophen-2-yl)amino]-1-oxopropan-2-yl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-[(3-carbamoyl-2-thienyl)amino]-2-keto-1-methyl-ethyl]piperidin-1-ium-4-carboxamide Formula: C14H21N4O3S+ MolecularWeight: 325.40654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CS1)C(=O)N)[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CS1)C(=O)N)[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C14H20N4O3S/c1-8(18-5-2-9(3-6-18)11(15)19)13(21)17-14-10(12(16)20)4-7-22-14/h4,7-9H,2-3,5-6H2,1H3,(H2,15,19)(H2,16,20)(H,17,21)/p+1/t8-/m0/s1