4-(4-chloranylphenoxy)-N-[[2,6-di(propan-2-yl)phenyl]carbamothioyl]butanamide

Systemtic Name: 4-(4-chloranylphenoxy)-N-[[2,6-di(propan-2-yl)phenyl]carbamothioyl]butanamide Openeye Name: 4-(4-chlorophenoxy)-N-[(2,6-diisopropylphenyl)carbamothioyl]butanamide CAS Name: 4-(4-chlorophenoxy)-N-[[2,6-di(propan-2-yl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 4-(4-chlorophenoxy)-N-[[2,6-di(propan-2-yl)phenyl]carbamothioyl]butanamide Traditional Name: 4-(4-chlorophenoxy)-N-[(2,6-diisopropylphenyl)thiocarbamoyl]butyramide Formula: C23H29ClN2O2S MolecularWeight: 433.00656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29ClN2O2S/c1-15(2)19-7-5-8-20(16(3)4)22(19)26-23(29)25-21(27)9-6-14-28-18-12-10-17(24)11-13-18/h5,7-8,10-13,15-16H,6,9,14H2,1-4H3,(H2,25,26,27,29)