[(3S)-4-ethoxy-4-oxidanylidene-3-[[(2R)-2-phenylpropanethioyl]amino]butan-2-ylidene]azanium

Systemtic Name: [(3S)-4-ethoxy-4-oxidanylidene-3-[[(2R)-2-phenylpropanethioyl]amino]butan-2-ylidene]azanium Openeye Name: [(2S)-3-ethoxy-1-methyl-3-oxo-2-[[(2R)-2-phenylpropanethioyl]amino]propylidene]ammonium CAS Name: [(3S)-4-ethoxy-4-oxo-3-[[(2R)-2-phenyl-1-sulfanylidenepropyl]amino]butan-2-ylidene]ammonium IUPAC Name: [(3S)-4-ethoxy-4-oxo-3-[[(2R)-2-phenylpropanethioyl]amino]butan-2-ylidene]azanium Traditional Name: [(2S)-3-ethoxy-3-keto-1-methyl-2-[[(2R)-2-phenylpropanethioyl]amino]propylidene]ammonium Formula: C15H21N2O2S+ MolecularWeight: 293.40444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=[NH2+])C)NC(=S)C(C)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)[C@H](C(=[NH2+])C)NC(=S)[C@H](C)C1=CC=CC=C1

InChI

InChI=1S/C15H20N2O2S/c1-4-19-15(18)13(11(3)16)17-14(20)10(2)12-8-6-5-7-9-12/h5-10,13,16H,4H2,1-3H3,(H,17,20)/p+1/t10-,13+/m1/s1