3-(dimethylamino)-N-[5-[[2-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]-1H-indazol-3-yl]benzamide

Systemtic Name: 3-(dimethylamino)-N-[5-[[2-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]-1H-indazol-3-yl]benzamide Openeye Name: 3-(dimethylamino)-N-[5-[[2-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]-3,4-dioxo-cyclobuten-1-yl]amino]-1H-indazol-3-yl]benzamide CAS Name: 3-(dimethylamino)-N-[5-[[2-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]-3,4-dioxo-1-cyclobutenyl]amino]-1H-indazol-3-yl]benzamide IUPAC Name: 3-(dimethylamino)-N-[5-[[2-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]-3,4-dioxocyclobuten-1-yl]amino]-1H-indazol-3-yl]benzamide Traditional Name: 3-(dimethylamino)-N-[5-[[2-[[(1R)-1-(3-hydroxyphenyl)ethyl]amino]-3,4-diketo-cyclobuten-1-yl]amino]-1H-indazol-3-yl]benzamide Formula: C28H26N6O4 MolecularWeight: 510.54384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)O)NC2=C(C(=O)C2=O)NC3=CC4=C(C=C3)NN=C4NC(=O)C5=CC(=CC=C5)N(C)C

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)O)NC2=C(C(=O)C2=O)NC3=CC4=C(C=C3)NN=C4NC(=O)C5=CC(=CC=C5)N(C)C

InChI

InChI=1S/C28H26N6O4/c1-15(16-6-5-9-20(35)13-16)29-23-24(26(37)25(23)36)30-18-10-11-22-21(14-18)27(33-32-22)31-28(38)17-7-4-8-19(12-17)34(2)3/h4-15,29-30,35H,1-3H3,(H2,31,32,33,38)/t15-/m1/s1