N-[(4-carbamimidoylphenyl)methyl]-2-[2-methyl-6-oxidanylidene-5-(propylamino)pyrimidin-1-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-methyl-6-oxidanylidene-5-(propylamino)pyrimidin-1-yl]ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-methyl-6-oxo-5-(propylamino)pyrimidin-1-yl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-methyl-6-oxo-5-(propylamino)-1-pyrimidinyl]acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[2-methyl-6-oxo-5-(propylamino)pyrimidin-1-yl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[6-keto-2-methyl-5-(propylamino)pyrimidin-1-yl]acetamide Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=CN=C(N(C1=O)CC(=O)NCC2=CC=C(C=C2)C(=N)N)C

Isomeric SMILES

CCCNC1=CN=C(N(C1=O)CC(=O)NCC2=CC=C(C=C2)C(=N)N)C

InChI

InChI=1S/C18H24N6O2/c1-3-8-21-15-10-22-12(2)24(18(15)26)11-16(25)23-9-13-4-6-14(7-5-13)17(19)20/h4-7,10,21H,3,8-9,11H2,1-2H3,(H3,19,20)(H,23,25)