N-butyl-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]dodecanamide

Systemtic Name: N-butyl-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]dodecanamide Openeye Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-butyl-dodecanamide CAS Name: N-butyl-N-[2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]dodecanamide IUPAC Name: N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-butyldodecanamide Traditional Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-butyl-lauramide Formula: C31H48N2O2S MolecularWeight: 512.79002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N(CCCC)CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C

Isomeric SMILES

CCCCCCCCCCCC(=O)N(CCCC)CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C

InChI

InChI=1S/C31H48N2O2S/c1-4-6-8-9-10-11-12-13-17-20-30(34)32(23-7-5-2)26-31(35)33(24-28-18-15-14-16-19-28)25-29-22-21-27(3)36-29/h14-16,18-19,21-22H,4-13,17,20,23-26H2,1-3H3