4-bromanyl-N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide

Systemtic Name: 4-bromanyl-N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide Openeye Name: 4-bromo-N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide CAS Name: 4-bromo-N-[(E)-[2-[(tert-butylhydrazo)-oxomethyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide IUPAC Name: 4-bromo-N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]benzamide Traditional Name: 4-bromo-N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]benzamide Formula: C21H25BrN4O3 MolecularWeight: 461.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=C(C=C3)Br)CCC2)C(=O)NNC(C)(C)C

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=C(C=C3)Br)/CCC2)C(=O)NNC(C)(C)C

InChI

InChI=1S/C21H25BrN4O3/c1-12-17-15(23-24-19(27)13-8-10-14(22)11-9-13)6-5-7-16(17)29-18(12)20(28)25-26-21(2,3)4/h8-11,26H,5-7H2,1-4H3,(H,24,27)(H,25,28)/b23-15+