2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-methyl-amino]-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-methyl-amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-methyl-amino]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[(4-ethoxy-3-methylphenyl)sulfonyl-methylamino]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[(4-ethoxy-3-methylphenyl)sulfonyl-methylamino]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-methyl-amino]-N-(4-pyridylmethyl)acetamide Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NCC2=CC=NC=C2)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NCC2=CC=NC=C2)C

InChI

InChI=1S/C18H23N3O4S/c1-4-25-17-6-5-16(11-14(17)2)26(23,24)21(3)13-18(22)20-12-15-7-9-19-10-8-15/h5-11H,4,12-13H2,1-3H3,(H,20,22)