4-azanyl-5-chloranyl-2-methoxy-N-[[4-(phenylmethyl)thiomorpholin-2-yl]methyl]benzamide

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[[4-(phenylmethyl)thiomorpholin-2-yl]methyl]benzamide Openeye Name: 4-amino-N-[(4-benzylthiomorpholin-2-yl)methyl]-5-chloro-2-methoxy-benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[[4-(phenylmethyl)-2-thiomorpholinyl]methyl]benzamide IUPAC Name: 4-amino-N-[(4-benzylthiomorpholin-2-yl)methyl]-5-chloro-2-methoxybenzamide Traditional Name: 4-amino-N-[(4-benzylthiomorpholin-2-yl)methyl]-5-chloro-2-methoxy-benzamide Formula: C20H24ClN3O2S MolecularWeight: 405.94146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCC2CN(CCS2)CC3=CC=CC=C3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCC2CN(CCS2)CC3=CC=CC=C3)Cl)N

InChI

InChI=1S/C20H24ClN3O2S/c1-26-19-10-18(22)17(21)9-16(19)20(25)23-11-15-13-24(7-8-27-15)12-14-5-3-2-4-6-14/h2-6,9-10,15H,7-8,11-13,22H2,1H3,(H,23,25)