5-[(E)-2-(7-methyl-1H-indol-4-yl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine

Systemtic Name: 5-[(E)-2-(7-methyl-1H-indol-4-yl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine Openeye Name: 5-[(E)-2-(7-methyl-1H-indol-4-yl)vinyl]-N-[4-(4-piperidylsulfonyl)phenyl]pyrimidin-2-amine CAS Name: 5-[(E)-2-(7-methyl-1H-indol-4-yl)ethenyl]-N-[4-(4-piperidinylsulfonyl)phenyl]-2-pyrimidinamine IUPAC Name: 5-[(E)-2-(7-methyl-1H-indol-4-yl)ethenyl]-N-(4-piperidin-4-ylsulfonylphenyl)pyrimidin-2-amine Traditional Name: [5-[(E)-2-(7-methyl-1H-indol-4-yl)vinyl]pyrimidin-2-yl]-[4-(4-piperidylsulfonyl)phenyl]amine Formula: C26H27N5O2S MolecularWeight: 473.58988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C=CC3=CN=C(N=C3)NC4=CC=C(C=C4)S(=O)(=O)C5CCNCC5)C=CN2

Isomeric SMILES

CC1=C2C(=C(C=C1)/C=C/C3=CN=C(N=C3)NC4=CC=C(C=C4)S(=O)(=O)C5CCNCC5)C=CN2

InChI

InChI=1S/C26H27N5O2S/c1-18-2-4-20(24-12-15-28-25(18)24)5-3-19-16-29-26(30-17-19)31-21-6-8-22(9-7-21)34(32,33)23-10-13-27-14-11-23/h2-9,12,15-17,23,27-28H,10-11,13-14H2,1H3,(H,29,30,31)/b5-3+