[3-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanyl-propyl] butanoate

Systemtic Name: [3-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanyl-propyl] butanoate Openeye Name: [3-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-hydroxy-propyl] butanoate CAS Name: butanoic acid [2-hydroxy-3-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]propyl] ester IUPAC Name: [3-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-hydroxypropyl] butanoate Traditional Name: butyric acid [3-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-hydroxy-propyl] ester Formula: C20H27NO3S MolecularWeight: 361.49828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(CN(CC1=CC=CC=C1)CC2=CC=C(S2)C)O

Isomeric SMILES

CCCC(=O)OCC(CN(CC1=CC=CC=C1)CC2=CC=C(S2)C)O

InChI

InChI=1S/C20H27NO3S/c1-3-7-20(23)24-15-18(22)13-21(12-17-8-5-4-6-9-17)14-19-11-10-16(2)25-19/h4-6,8-11,18,22H,3,7,12-15H2,1-2H3