(3S)-3-[[5-(5-methylfuran-2-yl)-1,2,4-triazin-3-yl]amino]azepan-2-one

Systemtic Name: (3S)-3-[[5-(5-methylfuran-2-yl)-1,2,4-triazin-3-yl]amino]azepan-2-one Openeye Name: (3S)-3-[[5-(5-methyl-2-furyl)-1,2,4-triazin-3-yl]amino]azepan-2-one CAS Name: (3S)-3-[[5-(5-methyl-2-furanyl)-1,2,4-triazin-3-yl]amino]-2-azepanone IUPAC Name: (3S)-3-[[5-(5-methylfuran-2-yl)-1,2,4-triazin-3-yl]amino]azepan-2-one Traditional Name: (3S)-3-[[5-(5-methyl-2-furyl)-1,2,4-triazin-3-yl]amino]azepan-2-one Formula: C14H17N5O2 MolecularWeight: 287.31708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=CN=NC(=N2)NC3CCCCNC3=O

Isomeric SMILES

CC1=CC=C(O1)C2=CN=NC(=N2)N[C@H]3CCCCNC3=O

InChI

InChI=1S/C14H17N5O2/c1-9-5-6-12(21-9)11-8-16-19-14(18-11)17-10-4-2-3-7-15-13(10)20/h5-6,8,10H,2-4,7H2,1H3,(H,15,20)(H,17,18,19)/t10-/m0/s1