4-(4-chloranylphenoxy)-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]butanamide

Systemtic Name: 4-(4-chloranylphenoxy)-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]butanamide Openeye Name: 4-(4-chlorophenoxy)-N-[(4-iodo-2-methyl-phenyl)carbamothioyl]butanamide CAS Name: 4-(4-chlorophenoxy)-N-[(4-iodo-2-methylanilino)-sulfanylidenemethyl]butanamide IUPAC Name: 4-(4-chlorophenoxy)-N-[(4-iodo-2-methylphenyl)carbamothioyl]butanamide Traditional Name: 4-(4-chlorophenoxy)-N-[(4-iodo-2-methyl-phenyl)thiocarbamoyl]butyramide Formula: C18H18ClIN2O2S MolecularWeight: 488.77019

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClIN2O2S/c1-12-11-14(20)6-9-16(12)21-18(25)22-17(23)3-2-10-24-15-7-4-13(19)5-8-15/h4-9,11H,2-3,10H2,1H3,(H2,21,22,23,25)