2-[1-[4-(6-methyl-2-oxidanylidene-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-nitro-phenyl]piperidin-4-yl]guanidine

Systemtic Name: 2-[1-[4-(6-methyl-2-oxidanylidene-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-nitro-phenyl]piperidin-4-yl]guanidine Openeye Name: 2-[1-[4-(6-methyl-2-oxo-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-nitro-phenyl]-4-piperidyl]guanidine CAS Name: 2-[1-[4-(6-methyl-2-oxo-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-nitrophenyl]-4-piperidinyl]guanidine IUPAC Name: 2-[1-[4-(6-methyl-2-oxo-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-nitrophenyl]piperidin-4-yl]guanidine Traditional Name: 2-[1-[4-(2-keto-6-methyl-3,6-dihydro-1,3,4-thiadiazin-5-yl)-2-nitro-phenyl]-4-piperidyl]guanidine Formula: C16H21N7O3S MolecularWeight: 391.44804

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NNC(=O)S1)C2=CC(=C(C=C2)N3CCC(CC3)N=C(N)N)[N+](=O)[O-]

Isomeric SMILES

CC1C(=NNC(=O)S1)C2=CC(=C(C=C2)N3CCC(CC3)N=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C16H21N7O3S/c1-9-14(20-21-16(24)27-9)10-2-3-12(13(8-10)23(25)26)22-6-4-11(5-7-22)19-15(17)18/h2-3,8-9,11H,4-7H2,1H3,(H,21,24)(H4,17,18,19)