1-[[1-(7-chloranyl-3-methyl-2-oxidanylidene-1H-quinoxalin-6-yl)pyrrol-3-yl]methyl]-3-phenyl-urea

Systemtic Name: 1-[[1-(7-chloranyl-3-methyl-2-oxidanylidene-1H-quinoxalin-6-yl)pyrrol-3-yl]methyl]-3-phenyl-urea Openeye Name: 1-[[1-(7-chloro-3-methyl-2-oxo-1H-quinoxalin-6-yl)pyrrol-3-yl]methyl]-3-phenyl-urea CAS Name: 1-[[1-(7-chloro-3-methyl-2-oxo-1H-quinoxalin-6-yl)-3-pyrrolyl]methyl]-3-phenylurea IUPAC Name: 1-[[1-(7-chloro-3-methyl-2-oxo-1H-quinoxalin-6-yl)pyrrol-3-yl]methyl]-3-phenylurea Traditional Name: 1-[[1-(7-chloro-2-keto-3-methyl-1H-quinoxalin-6-yl)pyrrol-3-yl]methyl]-3-phenyl-urea Formula: C21H18ClN5O2 MolecularWeight: 407.85292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2NC1=O)Cl)N3C=CC(=C3)CNC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC(=C(C=C2NC1=O)Cl)N3C=CC(=C3)CNC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H18ClN5O2/c1-13-20(28)26-17-9-16(22)19(10-18(17)24-13)27-8-7-14(12-27)11-23-21(29)25-15-5-3-2-4-6-15/h2-10,12H,11H2,1H3,(H,26,28)(H2,23,25,29)