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

Systemtic Name: N-[(2-bromanyl-4-methyl-phenyl)carbamothioyl]-4-phenoxy-butanamide Openeye Name: N-[(2-bromo-4-methyl-phenyl)carbamothioyl]-4-phenoxy-butanamide CAS Name: N-[(2-bromo-4-methylanilino)-sulfanylidenemethyl]-4-phenoxybutanamide IUPAC Name: N-[(2-bromo-4-methylphenyl)carbamothioyl]-4-phenoxybutanamide Traditional Name: N-[(2-bromo-4-methyl-phenyl)thiocarbamoyl]-4-phenoxy-butyramide Formula: C18H19BrN2O2S MolecularWeight: 407.32466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN2O2S/c1-13-9-10-16(15(19)12-13)20-18(24)21-17(22)8-5-11-23-14-6-3-2-4-7-14/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H2,20,21,22,24)