6-azanyl-1-cyclopropyl-5-[2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-cyclopropyl-5-[2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-cyclopropyl-5-[2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-cyclopropyl-5-[2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylamino]-1-oxoethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-cyclopropyl-5-[2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methylamino]acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-cyclopropyl-5-[2-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl-methyl-amino]acetyl]pyrimidine-2,4-quinone Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)CC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

Isomeric SMILES

CCN1C[C@@H](OC2=CC=CC=C21)CN(C)CC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

InChI

InChI=1S/C21H27N5O4/c1-3-25-11-14(30-17-7-5-4-6-15(17)25)10-24(2)12-16(27)18-19(22)26(13-8-9-13)21(29)23-20(18)28/h4-7,13-14H,3,8-12,22H2,1-2H3,(H,23,28,29)/t14-/m0/s1