N-[(5-chloranyl-2-methyl-phenyl)carbamothioyl]-4-phenoxy-butanamide

Systemtic Name: N-[(5-chloranyl-2-methyl-phenyl)carbamothioyl]-4-phenoxy-butanamide Openeye Name: N-[(5-chloro-2-methyl-phenyl)carbamothioyl]-4-phenoxy-butanamide CAS Name: N-[(5-chloro-2-methylanilino)-sulfanylidenemethyl]-4-phenoxybutanamide IUPAC Name: N-[(5-chloro-2-methylphenyl)carbamothioyl]-4-phenoxybutanamide Traditional Name: N-[(5-chloro-2-methyl-phenyl)thiocarbamoyl]-4-phenoxy-butyramide Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)NC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)NC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C18H19ClN2O2S/c1-13-9-10-14(19)12-16(13)20-18(24)21-17(22)8-5-11-23-15-6-3-2-4-7-15/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H2,20,21,22,24)