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

Systemtic Name: 5-nitro-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazole Openeye Name: 5-nitro-2-[[4-phenethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]thiazole CAS Name: 5-nitro-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]thiazole IUPAC Name: 5-nitro-2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazole Traditional Name: 5-nitro-2-[[4-phenethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]thiazole Formula: C17H13N5O2S3 MolecularWeight: 415.51242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NN=C2SC3=NC=C(S3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NN=C2SC3=NC=C(S3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C17H13N5O2S3/c23-22(24)14-11-18-17(26-14)27-16-20-19-15(13-7-4-10-25-13)21(16)9-8-12-5-2-1-3-6-12/h1-7,10-11H,8-9H2