methyl N-[3-(butanoylamino)phenyl]carbamodithioate

Systemtic Name: methyl N-[3-(butanoylamino)phenyl]carbamodithioate Openeye Name: methyl N-[3-(butanoylamino)phenyl]carbamodithioate CAS Name: N-[3-(1-oxobutylamino)phenyl]carbamodithioic acid methyl ester IUPAC Name: methyl N-[3-(butanoylamino)phenyl]carbamodithioate Traditional Name: N-(3-butyramidophenyl)carbamodithioic acid methyl ester Formula: C12H16N2OS2 MolecularWeight: 268.39824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=S)SC

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=S)SC

InChI

InChI=1S/C12H16N2OS2/c1-3-5-11(15)13-9-6-4-7-10(8-9)14-12(16)17-2/h4,6-8H,3,5H2,1-2H3,(H,13,15)(H,14,16)