N-[(E)-[1-(azepan-1-ylmethyl)-5-bromanyl-2-oxidanylidene-indol-3-ylidene]amino]-4-(dimethylamino)benzamide

Systemtic Name: N-[(E)-[1-(azepan-1-ylmethyl)-5-bromanyl-2-oxidanylidene-indol-3-ylidene]amino]-4-(dimethylamino)benzamide Openeye Name: N-[(E)-[1-(azepan-1-ylmethyl)-5-bromo-2-oxo-indolin-3-ylidene]amino]-4-(dimethylamino)benzamide CAS Name: N-[(E)-[1-(1-azepanylmethyl)-5-bromo-2-oxo-3-indolylidene]amino]-4-(dimethylamino)benzamide IUPAC Name: N-[(E)-[1-(azepan-1-ylmethyl)-5-bromo-2-oxoindol-3-ylidene]amino]-4-(dimethylamino)benzamide Traditional Name: N-[(E)-[1-(azepan-1-ylmethyl)-5-bromo-2-keto-indolin-3-ylidene]amino]-4-(dimethylamino)benzamide Formula: C24H28BrN5O2 MolecularWeight: 498.41542

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CN4CCCCCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N/N=C/2\C3=C(C=CC(=C3)Br)N(C2=O)CN4CCCCCC4

InChI

InChI=1S/C24H28BrN5O2/c1-28(2)19-10-7-17(8-11-19)23(31)27-26-22-20-15-18(25)9-12-21(20)30(24(22)32)16-29-13-5-3-4-6-14-29/h7-12,15H,3-6,13-14,16H2,1-2H3,(H,27,31)/b26-22+