2-phenethyl-5-pyrrol-1-yl-1,3,4-thiadiazole

Systemtic Name: 2-phenethyl-5-pyrrol-1-yl-1,3,4-thiadiazole Openeye Name: 2-phenethyl-5-pyrrol-1-yl-1,3,4-thiadiazole CAS Name: 2-phenethyl-5-(1-pyrrolyl)-1,3,4-thiadiazole IUPAC Name: 2-phenethyl-5-pyrrol-1-yl-1,3,4-thiadiazole Traditional Name: 2-phenethyl-5-pyrrol-1-yl-1,3,4-thiadiazole Formula: C14H13N3S MolecularWeight: 255.33812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NN=C(S2)N3C=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NN=C(S2)N3C=CC=C3

InChI

InChI=1S/C14H13N3S/c1-2-6-12(7-3-1)8-9-13-15-16-14(18-13)17-10-4-5-11-17/h1-7,10-11H,8-9H2