methyl N-octan-2-yl-N-[4-(octan-2-ylamino)phenyl]carbamodithioate

Systemtic Name: methyl N-octan-2-yl-N-[4-(octan-2-ylamino)phenyl]carbamodithioate Openeye Name: methyl N-(1-methylheptyl)-N-[4-(1-methylheptylamino)phenyl]carbamodithioate CAS Name: N-octan-2-yl-N-[4-(octan-2-ylamino)phenyl]carbamodithioic acid methyl ester IUPAC Name: methyl N-octan-2-yl-N-[4-(octan-2-ylamino)phenyl]carbamodithioate Traditional Name: N-(1-methylheptyl)-N-[4-(1-methylheptylamino)phenyl]carbamodithioic acid methyl ester Formula: C24H42N2S2 MolecularWeight: 422.73368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC1=CC=C(C=C1)N(C(C)CCCCCC)C(=S)SC

Isomeric SMILES

CCCCCCC(C)NC1=CC=C(C=C1)N(C(C)CCCCCC)C(=S)SC

InChI

InChI=1S/C24H42N2S2/c1-6-8-10-12-14-20(3)25-22-16-18-23(19-17-22)26(24(27)28-5)21(4)15-13-11-9-7-2/h16-21,25H,6-15H2,1-5H3