N-(diphenylmethyl)-2-[(4-ethanoyl-3-methyl-phenoxy)methyl]morpholine-4-carbothioamide

Systemtic Name: N-(diphenylmethyl)-2-[(4-ethanoyl-3-methyl-phenoxy)methyl]morpholine-4-carbothioamide Openeye Name: 2-[(4-acetyl-3-methyl-phenoxy)methyl]-N-benzhydryl-morpholine-4-carbothioamide CAS Name: 2-[(4-acetyl-3-methylphenoxy)methyl]-N-(diphenylmethyl)-4-morpholinecarbothioamide IUPAC Name: 2-[(4-acetyl-3-methylphenoxy)methyl]-N-benzhydrylmorpholine-4-carbothioamide Traditional Name: 2-[(4-acetyl-3-methyl-phenoxy)methyl]-N-benzhydryl-morpholine-4-carbothioamide Formula: C28H30N2O3S MolecularWeight: 474.6144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2CN(CCO2)C(=S)NC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2CN(CCO2)C(=S)NC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C28H30N2O3S/c1-20-17-24(13-14-26(20)21(2)31)33-19-25-18-30(15-16-32-25)28(34)29-27(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-14,17,25,27H,15-16,18-19H2,1-2H3,(H,29,34)