(3S)-3-(2-aminophenyl)sulfanyl-3-(2-chloranyl-3,4-dimethoxy-phenyl)-1-thiophen-2-yl-propan-1-one

Systemtic Name: (3S)-3-(2-aminophenyl)sulfanyl-3-(2-chloranyl-3,4-dimethoxy-phenyl)-1-thiophen-2-yl-propan-1-one Openeye Name: (3S)-3-(2-aminophenyl)sulfanyl-3-(2-chloro-3,4-dimethoxy-phenyl)-1-(2-thienyl)propan-1-one CAS Name: (3S)-3-[(2-aminophenyl)thio]-3-(2-chloro-3,4-dimethoxyphenyl)-1-thiophen-2-yl-1-propanone IUPAC Name: (3S)-3-(2-aminophenyl)sulfanyl-3-(2-chloro-3,4-dimethoxyphenyl)-1-thiophen-2-ylpropan-1-one Traditional Name: (3S)-3-[(2-aminophenyl)thio]-3-(2-chloro-3,4-dimethoxy-phenyl)-1-(2-thienyl)propan-1-one Formula: C21H20ClNO3S2 MolecularWeight: 433.9714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(CC(=O)C2=CC=CS2)SC3=CC=CC=C3N)Cl)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)[C@H](CC(=O)C2=CC=CS2)SC3=CC=CC=C3N)Cl)OC

InChI

InChI=1S/C21H20ClNO3S2/c1-25-16-10-9-13(20(22)21(16)26-2)19(12-15(24)18-8-5-11-27-18)28-17-7-4-3-6-14(17)23/h3-11,19H,12,23H2,1-2H3/t19-/m0/s1