2-[[4-(3-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole

Systemtic Name: 2-[[4-(3-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole Openeye Name: 2-[[4-(3-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-thiazole CAS Name: 2-[[4-(3-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-5-nitrothiazole IUPAC Name: 2-[[4-(3-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole Traditional Name: 2-[[4-(3-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-5-nitro-thiazole Formula: C18H13N5O3S2 MolecularWeight: 411.45752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=NN=C2SC3=NC=C(S3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=NN=C2SC3=NC=C(S3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C18H13N5O3S2/c1-26-14-9-5-8-13(10-14)22-16(12-6-3-2-4-7-12)20-21-17(22)28-18-19-11-15(27-18)23(24)25/h2-11H,1H3