2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-N-(furan-2-ylmethyl)benzamide Openeye Name: 2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]-N-(2-furylmethyl)benzamide CAS Name: 2-[[2-[(4,6-diamino-2-pyrimidinyl)thio]-1-oxoethyl]amino]-N-(2-furanylmethyl)benzamide IUPAC Name: 2-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]-N-(furan-2-ylmethyl)benzamide Traditional Name: 2-[[2-[(4,6-diaminopyrimidin-2-yl)thio]acetyl]amino]-N-(2-furfuryl)benzamide Formula: C18H18N6O3S MolecularWeight: 398.43892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC2=CC=CO2)NC(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC2=CC=CO2)NC(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C18H18N6O3S/c19-14-8-15(20)24-18(23-14)28-10-16(25)22-13-6-2-1-5-12(13)17(26)21-9-11-4-3-7-27-11/h1-8H,9-10H2,(H,21,26)(H,22,25)(H4,19,20,23,24)