N-(2-azanylethyl)-1-[(5-methyl-1,2-oxazol-3-yl)carbonyl]-3-(3-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-[(5-methyl-1,2-oxazol-3-yl)carbonyl]-3-(3-methylphenyl)carbonyl-1,3-diazinane-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(3-methylbenzoyl)-3-(5-methylisoxazole-3-carbonyl)hexahydropyrimidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(5-methyl-3-isoxazolyl)-oxomethyl]-3-[(3-methylphenyl)-oxomethyl]-1,3-diazinane-2-carboxamide IUPAC Name: N-(2-aminoethyl)-1-(3-methylbenzoyl)-3-(5-methyl-1,2-oxazole-3-carbonyl)-1,3-diazinane-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(5-methylisoxazole-3-carbonyl)-3-m-toluoyl-hexahydropyrimidine-2-carboxamide Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCCN(C2C(=O)NCCN)C(=O)C3=NOC(=C3)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCCN(C2C(=O)NCCN)C(=O)C3=NOC(=C3)C

InChI

InChI=1S/C20H25N5O4/c1-13-5-3-6-15(11-13)19(27)24-9-4-10-25(18(24)17(26)22-8-7-21)20(28)16-12-14(2)29-23-16/h3,5-6,11-12,18H,4,7-10,21H2,1-2H3,(H,22,26)