4-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-(thiophen-2-ylmethyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[1,1-bis(oxidanylidene)thiolan-3-yl]-(thiophen-2-ylmethyl)amino]methyl]benzenecarbonitrile Openeye Name: 4-[[(1,1-dioxothiolan-3-yl)-(2-thienylmethyl)amino]methyl]benzonitrile CAS Name: 4-[[(1,1-dioxo-3-thiolanyl)-(thiophen-2-ylmethyl)amino]methyl]benzonitrile IUPAC Name: 4-[[(1,1-dioxothiolan-3-yl)-(thiophen-2-ylmethyl)amino]methyl]benzonitrile Traditional Name: 4-[[(1,1-diketothiolan-3-yl)-(2-thenyl)amino]methyl]benzonitrile Formula: C17H18N2O2S2 MolecularWeight: 346.46702

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N(CC2=CC=C(C=C2)C#N)CC3=CC=CS3

Isomeric SMILES

C1CS(=O)(=O)CC1N(CC2=CC=C(C=C2)C#N)CC3=CC=CS3

InChI

InChI=1S/C17H18N2O2S2/c18-10-14-3-5-15(6-4-14)11-19(12-17-2-1-8-22-17)16-7-9-23(20,21)13-16/h1-6,8,16H,7,9,11-13H2