(Z)-2-tert-butylsulfonyl-3-[4-(diphenylmethyl)piperazin-1-yl]prop-2-enenitrile

Systemtic Name: (Z)-2-tert-butylsulfonyl-3-[4-(diphenylmethyl)piperazin-1-yl]prop-2-enenitrile Openeye Name: (Z)-3-(4-benzhydrylpiperazin-1-yl)-2-tert-butylsulfonyl-prop-2-enenitrile CAS Name: (Z)-2-tert-butylsulfonyl-3-[4-(diphenylmethyl)-1-piperazinyl]-2-propenenitrile IUPAC Name: (Z)-3-(4-benzhydrylpiperazin-1-yl)-2-tert-butylsulfonylprop-2-enenitrile Traditional Name: (Z)-3-(4-benzhydrylpiperazino)-2-tert-butylsulfonyl-acrylonitrile Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C(=CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)(C)S(=O)(=O)/C(=C\N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)/C#N

InChI

InChI=1S/C24H29N3O2S/c1-24(2,3)30(28,29)22(18-25)19-26-14-16-27(17-15-26)23(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,19,23H,14-17H2,1-3H3/b22-19-