4-azanyl-N-[3-[(3-isocyanophenyl)amino]-1H-indazol-5-yl]-2-(3-methoxyphenyl)butanamide

Systemtic Name: 4-azanyl-N-[3-[(3-isocyanophenyl)amino]-1H-indazol-5-yl]-2-(3-methoxyphenyl)butanamide Openeye Name: 4-amino-N-[3-(3-isocyanoanilino)-1H-indazol-5-yl]-2-(3-methoxyphenyl)butanamide CAS Name: 4-amino-N-[3-(3-isocyanoanilino)-1H-indazol-5-yl]-2-(3-methoxyphenyl)butanamide IUPAC Name: 4-amino-N-[3-(3-isocyanoanilino)-1H-indazol-5-yl]-2-(3-methoxyphenyl)butanamide Traditional Name: 4-amino-N-[3-(3-isocyanoanilino)-1H-indazol-5-yl]-2-(3-methoxyphenyl)butyramide Formula: C25H24N6O2 MolecularWeight: 440.49706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CCN)C(=O)NC2=CC3=C(C=C2)NN=C3NC4=CC=CC(=C4)[N+]#[C-]

Isomeric SMILES

COC1=CC=CC(=C1)C(CCN)C(=O)NC2=CC3=C(C=C2)NN=C3NC4=CC=CC(=C4)[N+]#[C-]

InChI

InChI=1S/C25H24N6O2/c1-27-17-6-4-7-18(14-17)28-24-22-15-19(9-10-23(22)30-31-24)29-25(32)21(11-12-26)16-5-3-8-20(13-16)33-2/h3-10,13-15,21H,11-12,26H2,2H3,(H,29,32)(H2,28,30,31)