N-(azepan-1-ylcarbothioyl)-4-[2,4-bis(chloranyl)phenoxy]butanamide

Systemtic Name: N-(azepan-1-ylcarbothioyl)-4-[2,4-bis(chloranyl)phenoxy]butanamide Openeye Name: N-(azepane-1-carbothioyl)-4-(2,4-dichlorophenoxy)butanamide CAS Name: N-[1-azepanyl(sulfanylidene)methyl]-4-(2,4-dichlorophenoxy)butanamide IUPAC Name: N-(azepane-1-carbothioyl)-4-(2,4-dichlorophenoxy)butanamide Traditional Name: N-(azepane-1-carbothioyl)-4-(2,4-dichlorophenoxy)butyramide Formula: C17H22Cl2N2O2S MolecularWeight: 389.33978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H22Cl2N2O2S/c18-13-7-8-15(14(19)12-13)23-11-5-6-16(22)20-17(24)21-9-3-1-2-4-10-21/h7-8,12H,1-6,9-11H2,(H,20,22,24)