4-nitro-2-[5-(phenylmethyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]phenol

Systemtic Name: 4-nitro-2-[5-(phenylmethyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]phenol Openeye Name: 2-(5-benzyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-4-nitro-phenol CAS Name: 4-nitro-2-[5-(phenylmethyl)-2,3-dihydro-1,3,4-thiadiazol-2-yl]phenol IUPAC Name: 2-(5-benzyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-4-nitrophenol Traditional Name: 2-(5-benzyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)-4-nitro-phenol Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NNC(S2)C3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)CC2=NNC(S2)C3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C15H13N3O3S/c19-13-7-6-11(18(20)21)9-12(13)15-17-16-14(22-15)8-10-4-2-1-3-5-10/h1-7,9,15,17,19H,8H2