(5-chloranylthiophen-2-yl)methyl-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]-prop-2-enyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]-prop-2-enyl-azanium Openeye Name: allyl-[(1R)-2-anilino-1-methyl-2-oxo-ethyl]-[(5-chloro-2-thienyl)methyl]ammonium CAS Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[(5-chloro-2-thiophenyl)methyl]-prop-2-enylammonium IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl]-[(5-chlorothiophen-2-yl)methyl]-prop-2-enylazanium Traditional Name: allyl-[(1R)-2-anilino-2-keto-1-methyl-ethyl]-[(5-chloro-2-thienyl)methyl]ammonium Formula: C17H20ClN2OS+ MolecularWeight: 335.8715

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH+](CC=C)CC2=CC=C(S2)Cl

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)[NH+](CC=C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C17H19ClN2OS/c1-3-11-20(12-15-9-10-16(18)22-15)13(2)17(21)19-14-7-5-4-6-8-14/h3-10,13H,1,11-12H2,2H3,(H,19,21)/p+1/t13-/m1/s1