1,2-diethyl-3-[5-[[5-(3-methoxy-1,2-oxazol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]pyrimidin-4-yl]guanidine

Systemtic Name: 1,2-diethyl-3-[5-[[5-(3-methoxy-1,2-oxazol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]pyrimidin-4-yl]guanidine Openeye Name: 1,2-diethyl-3-[5-[[5-(3-methoxyisoxazol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]pyrimidin-4-yl]guanidine CAS Name: 1,2-diethyl-3-[5-[[[5-(3-methoxy-5-isoxazolyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-4-pyrimidinyl]guanidine IUPAC Name: 1,2-diethyl-3-[5-[[5-(3-methoxy-1,2-oxazol-5-yl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]pyrimidin-4-yl]guanidine Traditional Name: 1,2-diethyl-3-[5-[[[5-(3-methoxyisoxazol-5-yl)-1,3,4-oxadiazol-2-yl]thio]methyl]pyrimidin-4-yl]guanidine Formula: C16H20N8O3S MolecularWeight: 404.4468

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=NCC)NC1=NC=NC=C1CSC2=NN=C(O2)C3=CC(=NO3)OC

Isomeric SMILES

CCNC(=NCC)NC1=NC=NC=C1CSC2=NN=C(O2)C3=CC(=NO3)OC

InChI

InChI=1S/C16H20N8O3S/c1-4-18-15(19-5-2)21-13-10(7-17-9-20-13)8-28-16-23-22-14(26-16)11-6-12(25-3)24-27-11/h6-7,9H,4-5,8H2,1-3H3,(H2,17,18,19,20,21)