N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-2-(5-morpholinosulfonyl-2-thienyl)acetamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-[5-(4-morpholinylsulfonyl)-2-thiophenyl]acetamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-2-(5-morpholinosulfonyl-2-thienyl)acetamide Formula: C19H22BrN3O5S2 MolecularWeight: 516.42908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H22BrN3O5S2/c1-13-10-14(20)2-4-16(13)22-18(25)12-21-17(24)11-15-3-5-19(29-15)30(26,27)23-6-8-28-9-7-23/h2-5,10H,6-9,11-12H2,1H3,(H,21,24)(H,22,25)