N-[4-(cyanomethyl)phenyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C20H21N3O4S/c1-15-2-7-18(28(25,26)23-10-12-27-13-11-23)14-19(15)20(24)22-17-5-3-16(4-6-17)8-9-21/h2-7,14H,8,10-13H2,1H3,(H,22,24)