2-[bis(2-hydroxyethyl)amino]-1-(4-ethylsulfanylphenyl)-2-methyl-propan-1-one

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]-1-(4-ethylsulfanylphenyl)-2-methyl-propan-1-one Openeye Name: 2-[bis(2-hydroxyethyl)amino]-1-(4-ethylsulfanylphenyl)-2-methyl-propan-1-one CAS Name: 2-[bis(2-hydroxyethyl)amino]-1-[4-(ethylthio)phenyl]-2-methyl-1-propanone IUPAC Name: 2-[bis(2-hydroxyethyl)amino]-1-(4-ethylsulfanylphenyl)-2-methylpropan-1-one Traditional Name: 2-[bis(2-hydroxyethyl)amino]-1-[4-(ethylthio)phenyl]-2-methyl-propan-1-one Formula: C16H25NO3S MolecularWeight: 311.4396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)C(C)(C)N(CCO)CCO

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)C(C)(C)N(CCO)CCO

InChI

InChI=1S/C16H25NO3S/c1-4-21-14-7-5-13(6-8-14)15(20)16(2,3)17(9-11-18)10-12-19/h5-8,18-19H,4,9-12H2,1-3H3