[(1S)-2-[(3-chloranyl-6-methyl-1-benzothiophen-2-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(3-chloranyl-6-methyl-1-benzothiophen-2-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(3-chloro-6-methyl-benzothiophene-2-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(3-chloro-6-methyl-1-benzothiophen-2-yl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(3-chloro-6-methyl-benzothiophene-2-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C20H22ClN2OS+ MolecularWeight: 373.91948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NCC(C3=CC=CC=C3)[NH+](C)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC[C@H](C3=CC=CC=C3)[NH+](C)C)Cl

InChI

InChI=1S/C20H21ClN2OS/c1-13-9-10-15-17(11-13)25-19(18(15)21)20(24)22-12-16(23(2)3)14-7-5-4-6-8-14/h4-11,16H,12H2,1-3H3,(H,22,24)/p+1/t16-/m1/s1