[3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[[2-phenyl-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]ethyl]amino]propan-2-yl]carbamic acid

Systemtic Name: [3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-[[2-phenyl-2-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoylamino]ethyl]amino]propan-2-yl]carbamic acid Openeye Name: [1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-[[2-phenyl-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]ethyl]amino]ethyl]carbamic acid CAS Name: [3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[[2-[[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]amino]-2-phenylethyl]amino]propan-2-yl]carbamic acid IUPAC Name: [3-(1H-indol-3-yl)-2-methyl-1-oxo-1-[[2-phenyl-2-[[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]amino]ethyl]amino]propan-2-yl]carbamic acid Traditional Name: [1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-2-[[2-phenyl-2-[[2-(1H-1,2,4-triazol-5-ylthio)acetyl]amino]ethyl]amino]ethyl]carbamic acid Formula: C25H27N7O4S MolecularWeight: 521.59138

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCC(C3=CC=CC=C3)NC(=O)CSC4=NC=NN4)NC(=O)O

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCC(C3=CC=CC=C3)NC(=O)CSC4=NC=NN4)NC(=O)O

InChI

InChI=1S/C25H27N7O4S/c1-25(31-24(35)36,11-17-12-26-19-10-6-5-9-18(17)19)22(34)27-13-20(16-7-3-2-4-8-16)30-21(33)14-37-23-28-15-29-32-23/h2-10,12,15,20,26,31H,11,13-14H2,1H3,(H,27,34)(H,30,33)(H,35,36)(H,28,29,32)