(phenylmethyl) N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-propan-2-yl-carbamodithioate

Systemtic Name: (phenylmethyl) N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-propan-2-yl-carbamodithioate Openeye Name: benzyl N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-isopropyl-carbamodithioate CAS Name: N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-propan-2-ylcarbamodithioic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-propan-2-ylcarbamodithioate Traditional Name: N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-isopropyl-carbamodithioic acid benzyl ester Formula: C26H36N2S2 MolecularWeight: 440.70744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1CCC(CC1)C2=CC=C(C=C2)CN(C)C)C(=S)SCC3=CC=CC=C3

Isomeric SMILES

CC(C)N(C1CCC(CC1)C2=CC=C(C=C2)CN(C)C)C(=S)SCC3=CC=CC=C3

InChI

InChI=1S/C26H36N2S2/c1-20(2)28(26(29)30-19-22-8-6-5-7-9-22)25-16-14-24(15-17-25)23-12-10-21(11-13-23)18-27(3)4/h5-13,20,24-25H,14-19H2,1-4H3