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

Systemtic Name: N-(diphenylmethyl)-2-[(3-ethynylphenoxy)methyl]morpholine-4-carbothioamide Openeye Name: N-benzhydryl-2-[(3-ethynylphenoxy)methyl]morpholine-4-carbothioamide CAS Name: N-(diphenylmethyl)-2-[(3-ethynylphenoxy)methyl]-4-morpholinecarbothioamide IUPAC Name: N-benzhydryl-2-[(3-ethynylphenoxy)methyl]morpholine-4-carbothioamide Traditional Name: N-benzhydryl-2-[(3-ethynylphenoxy)methyl]morpholine-4-carbothioamide Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O2S/c1-2-21-10-9-15-24(18-21)31-20-25-19-29(16-17-30-25)27(32)28-26(22-11-5-3-6-12-22)23-13-7-4-8-14-23/h1,3-15,18,25-26H,16-17,19-20H2,(H,28,32)