methyl 2-[(2-chloranyl-6-methyl-phenyl)-methanethioyl-amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(2-chloranyl-6-methyl-phenyl)-methanethioyl-amino]-3-phenyl-propanoate Openeye Name: methyl 2-(2-chloro-N-methanethioyl-6-methyl-anilino)-3-phenyl-propanoate CAS Name: 2-(2-chloro-N-methanethioyl-6-methylanilino)-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-(2-chloro-N-methanethioyl-6-methylanilino)-3-phenylpropanoate Traditional Name: 2-(2-chloro-6-methyl-N-thioformyl-anilino)-3-phenyl-propionic acid methyl ester Formula: C18H18ClNO2S MolecularWeight: 347.85902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)N(C=S)C(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)N(C=S)C(CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H18ClNO2S/c1-13-7-6-10-15(19)17(13)20(12-23)16(18(21)22-2)11-14-8-4-3-5-9-14/h3-10,12,16H,11H2,1-2H3