N-[4-[[(2E)-2-phenacylidene-1,3-diazinan-1-yl]sulfonyl]phenyl]ethanamide

Systemtic Name: N-[4-[[(2E)-2-phenacylidene-1,3-diazinan-1-yl]sulfonyl]phenyl]ethanamide Openeye Name: N-[4-[(2E)-2-phenacylidenehexahydropyrimidin-1-yl]sulfonylphenyl]acetamide CAS Name: N-[4-[[(2E)-2-phenacylidene-1,3-diazinan-1-yl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[[(2E)-2-phenacylidene-1,3-diazinan-1-yl]sulfonyl]phenyl]acetamide Traditional Name: N-[4-[(2E)-2-phenacylidenehexahydropyrimidin-1-yl]sulfonylphenyl]acetamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCNC2=CC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N\2CCCN/C2=C\C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O4S/c1-15(24)22-17-8-10-18(11-9-17)28(26,27)23-13-5-12-21-20(23)14-19(25)16-6-3-2-4-7-16/h2-4,6-11,14,21H,5,12-13H2,1H3,(H,22,24)/b20-14+