2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)ethanamide Openeye Name: N-(cyclohexen-1-yl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2-furylmethyl)acetamide CAS Name: N-(1-cyclohexenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(2-furanylmethyl)acetamide IUPAC Name: N-(cyclohexen-1-yl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(furan-2-ylmethyl)acetamide Traditional Name: N-(cyclohexen-1-yl)-2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(2-furfuryl)acetamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)N(CC2=CC=CO2)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1CCC(=CC1)N(CC2=CC=CO2)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C17H21N5O2S/c18-14-9-15(19)21-17(20-14)25-11-16(23)22(10-13-7-4-8-24-13)12-5-2-1-3-6-12/h4-5,7-9H,1-3,6,10-11H2,(H4,18,19,20,21)