cyclohex-2-en-1-yl N-[3-(2-methylpropanoylamino)phenyl]carbamodithioate

Systemtic Name: cyclohex-2-en-1-yl N-[3-(2-methylpropanoylamino)phenyl]carbamodithioate Openeye Name: cyclohex-2-en-1-yl N-[3-(2-methylpropanoylamino)phenyl]carbamodithioate CAS Name: N-[3-[(2-methyl-1-oxopropyl)amino]phenyl]carbamodithioic acid 1-cyclohex-2-enyl ester IUPAC Name: cyclohex-2-en-1-yl N-[3-(2-methylpropanoylamino)phenyl]carbamodithioate Traditional Name: N-[3-(isobutyrylamino)phenyl]carbamodithioic acid cyclohex-2-en-1-yl ester Formula: C17H22N2OS2 MolecularWeight: 334.49938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)SC2CCCC=C2

Isomeric SMILES

CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)SC2CCCC=C2

InChI

InChI=1S/C17H22N2OS2/c1-12(2)16(20)18-13-7-6-8-14(11-13)19-17(21)22-15-9-4-3-5-10-15/h4,6-9,11-12,15H,3,5,10H2,1-2H3,(H,18,20)(H,19,21)