S-(dimethylamino) 2-[[3-(4-methoxyoxan-4-yl)phenyl]amino]-2-phenyl-ethanethioate; methanamine

Systemtic Name: S-(dimethylamino) 2-[[3-(4-methoxyoxan-4-yl)phenyl]amino]-2-phenyl-ethanethioate; methanamine Openeye Name: S-(dimethylamino) 2-[3-(4-methoxytetrahydropyran-4-yl)anilino]-2-phenyl-ethanethioate; methanamine CAS Name: methanamine; 2-[3-(4-methoxy-4-oxanyl)anilino]-2-phenylethanethioic acid S-(dimethylamino) ester IUPAC Name: S-(dimethylamino) 2-[3-(4-methoxyoxan-4-yl)anilino]-2-phenylethanethioate; methanamine Traditional Name: 2-[3-(4-methoxytetrahydropyran-4-yl)anilino]-2-phenyl-ethanethioic acid S-(dimethylamino) ester; methylamine Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CN.CN(C)SC(=O)C(C1=CC=CC=C1)NC2=CC=CC(=C2)C3(CCOCC3)OC

Isomeric SMILES

CN.CN(C)SC(=O)C(C1=CC=CC=C1)NC2=CC=CC(=C2)C3(CCOCC3)OC

InChI

InChI=1S/C22H28N2O3S.CH5N/c1-24(2)28-21(25)20(17-8-5-4-6-9-17)23-19-11-7-10-18(16-19)22(26-3)12-14-27-15-13-22;1-2/h4-11,16,20,23H,12-15H2,1-3H3;2H2,1H3