3-oxidanylidenebutyl N-(phenylmethyl)carbamodithioate

Systemtic Name: 3-oxidanylidenebutyl N-(phenylmethyl)carbamodithioate Openeye Name: 3-oxobutyl N-benzylcarbamodithioate CAS Name: N-(phenylmethyl)carbamodithioic acid 3-oxobutyl ester IUPAC Name: 3-oxobutyl N-benzylcarbamodithioate Traditional Name: N-benzylcarbamodithioic acid 3-ketobutyl ester Formula: C12H15NOS2 MolecularWeight: 253.3836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCSC(=S)NCC1=CC=CC=C1

Isomeric SMILES

CC(=O)CCSC(=S)NCC1=CC=CC=C1

InChI

InChI=1S/C12H15NOS2/c1-10(14)7-8-16-12(15)13-9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3,(H,13,15)