N-[1-dodecyl-3,5-bis[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]piperidin-4-ylidene]hydroxylamine

Systemtic Name: N-[1-dodecyl-3,5-bis[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]piperidin-4-ylidene]hydroxylamine Openeye Name: 1-dodecyl-3,5-bis[(1-phenyltetrazol-5-yl)sulfanyl]piperidin-4-one oxime CAS Name: 1-dodecyl-3,5-bis[(1-phenyl-5-tetrazolyl)thio]-4-piperidinone oxime IUPAC Name: N-[1-dodecyl-3,5-bis[(1-phenyltetrazol-5-yl)sulfanyl]piperidin-4-ylidene]hydroxylamine Traditional Name: 1-lauryl-3,5-bis[(1-phenyltetrazol-5-yl)thio]piperidin-4-one oxime Formula: C31H42N10OS2 MolecularWeight: 634.86158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1CC(C(=NO)C(C1)SC2=NN=NN2C3=CC=CC=C3)SC4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

CCCCCCCCCCCCN1CC(C(=NO)C(C1)SC2=NN=NN2C3=CC=CC=C3)SC4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C31H42N10OS2/c1-2-3-4-5-6-7-8-9-10-17-22-39-23-27(43-30-32-35-37-40(30)25-18-13-11-14-19-25)29(34-42)28(24-39)44-31-33-36-38-41(31)26-20-15-12-16-21-26/h11-16,18-21,27-28,42H,2-10,17,22-24H2,1H3