N-[5-methoxy-2-methyl-4-[2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]benzamide

Systemtic Name: N-[5-methoxy-2-methyl-4-[2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]benzamide Openeye Name: N-[5-methoxy-2-methyl-4-[[2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]benzamide CAS Name: N-[5-methoxy-2-methyl-4-[[1-oxo-2-[[4-phenyl-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]ethyl]amino]phenyl]benzamide IUPAC Name: N-[5-methoxy-2-methyl-4-[[2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]benzamide Traditional Name: N-[5-methoxy-2-methyl-4-[[2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)thio]acetyl]amino]phenyl]benzamide Formula: C29H25N7O3S MolecularWeight: 551.6189

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=NC=CN=C5

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=NC=CN=C5

InChI

InChI=1S/C29H25N7O3S/c1-19-15-23(25(39-2)16-22(19)33-28(38)20-9-5-3-6-10-20)32-26(37)18-40-29-35-34-27(24-17-30-13-14-31-24)36(29)21-11-7-4-8-12-21/h3-17H,18H2,1-2H3,(H,32,37)(H,33,38)