3-acetamido-N-(2-azanylethyl)-4-(thiomorpholin-4-ylmethyl)benzamide

Systemtic Name: 3-acetamido-N-(2-azanylethyl)-4-(thiomorpholin-4-ylmethyl)benzamide Openeye Name: 3-acetamido-N-(2-aminoethyl)-4-(thiomorpholinomethyl)benzamide CAS Name: 3-acetamido-N-(2-aminoethyl)-4-(thiomorpholin-4-ylmethyl)benzamide IUPAC Name: 3-acetamido-N-(2-aminoethyl)-4-(thiomorpholin-4-ylmethyl)benzamide Traditional Name: 3-acetamido-N-(2-aminoethyl)-4-(thiomorpholinomethyl)benzamide Formula: C16H24N4O2S MolecularWeight: 336.45236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)NCCN)CN2CCSCC2

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)NCCN)CN2CCSCC2

InChI

InChI=1S/C16H24N4O2S/c1-12(21)19-15-10-13(16(22)18-5-4-17)2-3-14(15)11-20-6-8-23-9-7-20/h2-3,10H,4-9,11,17H2,1H3,(H,18,22)(H,19,21)