3-(3,4-diethoxyphenyl)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]propanamide

Systemtic Name: 3-(3,4-diethoxyphenyl)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]propanamide Openeye Name: 3-(3,4-diethoxyphenyl)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]propanamide CAS Name: 3-(3,4-diethoxyphenyl)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]propanamide IUPAC Name: 3-(3,4-diethoxyphenyl)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]propanamide Traditional Name: 3-(3,4-diethoxyphenyl)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]propionamide Formula: C27H31NO3S MolecularWeight: 449.60494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)CSC3=CC=CC=C3)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)CSC3=CC=CC=C3)C)OCC

InChI

InChI=1S/C27H31NO3S/c1-4-30-25-15-12-21(18-26(25)31-5-2)13-16-27(29)28-24-14-11-22(17-20(24)3)19-32-23-9-7-6-8-10-23/h6-12,14-15,17-18H,4-5,13,16,19H2,1-3H3,(H,28,29)