2-[3-(methylamino)-2-oxidanylidene-pyridin-1-yl]-N-[5-[(N'-methylcarbamimidoyl)amino]-1-oxidanylidene-1-(1,3-thiazol-2-yl)pentan-2-yl]ethanamide

Systemtic Name: 2-[3-(methylamino)-2-oxidanylidene-pyridin-1-yl]-N-[5-[(N'-methylcarbamimidoyl)amino]-1-oxidanylidene-1-(1,3-thiazol-2-yl)pentan-2-yl]ethanamide Openeye Name: 2-[3-(methylamino)-2-oxo-1-pyridyl]-N-[4-[(N'-methylcarbamimidoyl)amino]-1-(thiazole-2-carbonyl)butyl]acetamide CAS Name: N-[5-[[amino(methylimino)methyl]amino]-1-oxo-1-(2-thiazolyl)pentan-2-yl]-2-[3-(methylamino)-2-oxo-1-pyridinyl]acetamide IUPAC Name: 2-[3-(methylamino)-2-oxopyridin-1-yl]-N-[5-[(N'-methylcarbamimidoyl)amino]-1-oxo-1-(1,3-thiazol-2-yl)pentan-2-yl]acetamide Traditional Name: 2-[2-keto-3-(methylamino)-1-pyridyl]-N-[4-[(N'-methylamidino)amino]-1-(thiazole-2-carbonyl)butyl]acetamide Formula: C18H25N7O3S MolecularWeight: 419.5012

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=CN(C1=O)CC(=O)NC(CCCNC(=NC)N)C(=O)C2=NC=CS2

Isomeric SMILES

CNC1=CC=CN(C1=O)CC(=O)NC(CCCNC(=NC)N)C(=O)C2=NC=CS2

InChI

InChI=1S/C18H25N7O3S/c1-20-13-6-4-9-25(17(13)28)11-14(26)24-12(5-3-7-23-18(19)21-2)15(27)16-22-8-10-29-16/h4,6,8-10,12,20H,3,5,7,11H2,1-2H3,(H,24,26)(H3,19,21,23)