3-[3-[(3-bromophenyl)amino]-3-oxidanylidene-prop-1-ynyl]-4-methyl-N-(4-morpholin-4-ylphenyl)benzamide

Systemtic Name: 3-[3-[(3-bromophenyl)amino]-3-oxidanylidene-prop-1-ynyl]-4-methyl-N-(4-morpholin-4-ylphenyl)benzamide Openeye Name: 3-[3-(3-bromoanilino)-3-oxo-prop-1-ynyl]-4-methyl-N-(4-morpholinophenyl)benzamide CAS Name: 3-[3-(3-bromoanilino)-3-oxoprop-1-ynyl]-4-methyl-N-[4-(4-morpholinyl)phenyl]benzamide IUPAC Name: 3-[3-(3-bromoanilino)-3-oxoprop-1-ynyl]-4-methyl-N-(4-morpholin-4-ylphenyl)benzamide Traditional Name: 3-[3-(3-bromoanilino)-3-keto-prop-1-ynyl]-4-methyl-N-(4-morpholinophenyl)benzamide Formula: C27H24BrN3O3 MolecularWeight: 518.40176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCOCC3)C#CC(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCOCC3)C#CC(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C27H24BrN3O3/c1-19-5-6-21(17-20(19)7-12-26(32)29-24-4-2-3-22(28)18-24)27(33)30-23-8-10-25(11-9-23)31-13-15-34-16-14-31/h2-6,8-11,17-18H,13-16H2,1H3,(H,29,32)(H,30,33)