N-methyl-2-[1-(oxan-2-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazol-6-yl]sulfanyl-benzamide

Systemtic Name: N-methyl-2-[1-(oxan-2-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazol-6-yl]sulfanyl-benzamide Openeye Name: N-methyl-2-[3-[(E)-2-(2-pyridyl)vinyl]-1-tetrahydropyran-2-yl-indazol-6-yl]sulfanyl-benzamide CAS Name: N-methyl-2-[[1-(2-oxanyl)-3-[(E)-2-(2-pyridinyl)ethenyl]-6-indazolyl]thio]benzamide IUPAC Name: N-methyl-2-[1-(oxan-2-yl)-3-[(E)-2-pyridin-2-ylethenyl]indazol-6-yl]sulfanylbenzamide Traditional Name: N-methyl-2-[[3-[(E)-2-(2-pyridyl)vinyl]-1-tetrahydropyran-2-yl-indazol-6-yl]thio]benzamide Formula: C27H26N4O2S MolecularWeight: 470.58594

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1SC2=CC3=C(C=C2)C(=NN3C4CCCCO4)C=CC5=CC=CC=N5

Isomeric SMILES

CNC(=O)C1=CC=CC=C1SC2=CC3=C(C=C2)C(=NN3C4CCCCO4)/C=C/C5=CC=CC=N5

InChI

InChI=1S/C27H26N4O2S/c1-28-27(32)22-9-2-3-10-25(22)34-20-13-14-21-23(15-12-19-8-4-6-16-29-19)30-31(24(21)18-20)26-11-5-7-17-33-26/h2-4,6,8-10,12-16,18,26H,5,7,11,17H2,1H3,(H,28,32)/b15-12+