5-bromanyl-N-[[1-(cyanomethyl)indol-3-yl]methylideneamino]-7-methoxy-1-benzofuran-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[1-(cyanomethyl)indol-3-yl]methylideneamino]-7-methoxy-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-[[1-(cyanomethyl)indol-3-yl]methyleneamino]-7-methoxy-benzofuran-2-carboxamide CAS Name: 5-bromo-N-[[1-(cyanomethyl)-3-indolyl]methylideneamino]-7-methoxy-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-[[1-(cyanomethyl)indol-3-yl]methylideneamino]-7-methoxy-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-[[1-(cyanomethyl)indol-3-yl]methyleneamino]-7-methoxy-coumarilamide Formula: C21H15BrN4O3 MolecularWeight: 451.2728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)Br)C=C(O2)C(=O)NN=CC3=CN(C4=CC=CC=C43)CC#N

Isomeric SMILES

COC1=C2C(=CC(=C1)Br)C=C(O2)C(=O)NN=CC3=CN(C4=CC=CC=C43)CC#N

InChI

InChI=1S/C21H15BrN4O3/c1-28-18-10-15(22)8-13-9-19(29-20(13)18)21(27)25-24-11-14-12-26(7-6-23)17-5-3-2-4-16(14)17/h2-5,8-12H,7H2,1H3,(H,25,27)