(2,4-dichlorophenyl)methyl N-[3-(butanoylamino)phenyl]carbamodithioate

Systemtic Name: (2,4-dichlorophenyl)methyl N-[3-(butanoylamino)phenyl]carbamodithioate Openeye Name: (2,4-dichlorophenyl)methyl N-[3-(butanoylamino)phenyl]carbamodithioate CAS Name: N-[3-(1-oxobutylamino)phenyl]carbamodithioic acid (2,4-dichlorophenyl)methyl ester IUPAC Name: (2,4-dichlorophenyl)methyl N-[3-(butanoylamino)phenyl]carbamodithioate Traditional Name: N-(3-butyramidophenyl)carbamodithioic acid (2,4-dichlorobenzyl) ester Formula: C18H18Cl2N2OS2 MolecularWeight: 413.38432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=S)SCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=S)SCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H18Cl2N2OS2/c1-2-4-17(23)21-14-5-3-6-15(10-14)22-18(24)25-11-12-7-8-13(19)9-16(12)20/h3,5-10H,2,4,11H2,1H3,(H,21,23)(H,22,24)