N-[(4-butan-2-ylphenyl)methyl]-N-methyl-1-(1,4,7,11,14-pentathiacycloheptadec-12-yl)methanamine

Systemtic Name: N-[(4-butan-2-ylphenyl)methyl]-N-methyl-1-(1,4,7,11,14-pentathiacycloheptadec-12-yl)methanamine Openeye Name: N-methyl-1-(1,4,7,11,14-pentathiacycloheptadec-12-yl)-N-[(4-sec-butylphenyl)methyl]methanamine CAS Name: N-[(4-butan-2-ylphenyl)methyl]-N-methyl-1-(1,4,7,11,14-pentathiacycloheptadec-12-yl)methanamine IUPAC Name: N-[(4-butan-2-ylphenyl)methyl]-N-methyl-1-(1,4,7,11,14-pentathiacycloheptadec-12-yl)methanamine Traditional Name: methyl-(1,4,7,11,14-pentathiacycloheptadec-12-ylmethyl)-(4-sec-butylbenzyl)amine Formula: C25H43NS5 MolecularWeight: 517.94062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)CN(C)CC2CSCCCSCCSCCSCCCS2

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)CN(C)CC2CSCCCSCCSCCSCCCS2

InChI

InChI=1S/C25H43NS5/c1-4-22(2)24-9-7-23(8-10-24)19-26(3)20-25-21-30-13-5-11-27-15-17-29-18-16-28-12-6-14-31-25/h7-10,22,25H,4-6,11-21H2,1-3H3