[(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name: [(2R)-1-[(4-acetamidophenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: [(1R)-2-(4-acetamidoanilino)-1-methyl-2-oxo-ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl]-methyl-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: [(2R)-1-(4-acetamidoanilino)-1-oxopropan-2-yl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [(1R)-2-(4-acetamidoanilino)-2-keto-1-methyl-ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C18H24N3O2S+ MolecularWeight: 346.46706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](C)C(C)C(=O)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC1=C(SC=C1)C[NH+](C)[C@H](C)C(=O)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C18H23N3O2S/c1-12-9-10-24-17(12)11-21(4)13(2)18(23)20-16-7-5-15(6-8-16)19-14(3)22/h5-10,13H,11H2,1-4H3,(H,19,22)(H,20,23)/p+1/t13-/m1/s1