2-methyl-1-[2-methyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]pyrimidin-4-yl]-3-prop-2-ynyl-guanidine

Systemtic Name: 2-methyl-1-[2-methyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]pyrimidin-4-yl]-3-prop-2-ynyl-guanidine Openeye Name: 2-methyl-1-[2-methyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]pyrimidin-4-yl]-3-prop-2-ynyl-guanidine CAS Name: 2-methyl-1-[2-methyl-5-[[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-4-pyrimidinyl]-3-prop-2-ynylguanidine IUPAC Name: 2-methyl-1-[2-methyl-5-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]pyrimidin-4-yl]-3-prop-2-ynylguanidine Traditional Name: 2-methyl-1-[2-methyl-5-[[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]pyrimidin-4-yl]-3-propargyl-guanidine Formula: C19H18N8O3S MolecularWeight: 438.46302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)NC(=NC)NCC#C)CSC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(C(=N1)NC(=NC)NCC#C)CSC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N8O3S/c1-4-9-21-18(20-3)24-16-14(10-22-12(2)23-16)11-31-19-26-25-17(30-19)13-5-7-15(8-6-13)27(28)29/h1,5-8,10H,9,11H2,2-3H3,(H2,20,21,22,23,24)