4-(4-tert-butylphenoxy)-N-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]butanamide

Systemtic Name: 4-(4-tert-butylphenoxy)-N-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]butanamide Openeye Name: 4-(4-tert-butylphenoxy)-N-[(2-chloro-4,6-dimethyl-phenyl)carbamothioyl]butanamide CAS Name: 4-(4-tert-butylphenoxy)-N-[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]butanamide IUPAC Name: 4-(4-tert-butylphenoxy)-N-[(2-chloro-4,6-dimethylphenyl)carbamothioyl]butanamide Traditional Name: 4-(4-tert-butylphenoxy)-N-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoyl]butyramide Formula: C23H29ClN2O2S MolecularWeight: 433.00656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29ClN2O2S/c1-15-13-16(2)21(19(24)14-15)26-22(29)25-20(27)7-6-12-28-18-10-8-17(9-11-18)23(3,4)5/h8-11,13-14H,6-7,12H2,1-5H3,(H2,25,26,27,29)