3-[5-[2-(phenylsulfonyl)ethylsulfanyl]-1,2,3,4-tetrazol-1-yl]-N-prop-1-en-2-yl-aniline

Systemtic Name: 3-[5-[2-(phenylsulfonyl)ethylsulfanyl]-1,2,3,4-tetrazol-1-yl]-N-prop-1-en-2-yl-aniline Openeye Name: 3-[5-[2-(benzenesulfonyl)ethylsulfanyl]tetrazol-1-yl]-N-isopropenyl-aniline CAS Name: 3-[5-[2-(benzenesulfonyl)ethylthio]-1-tetrazolyl]-N-(1-methylethenyl)aniline IUPAC Name: 3-[5-[2-(benzenesulfonyl)ethylsulfanyl]tetrazol-1-yl]-N-prop-1-en-2-ylaniline Traditional Name: [3-[5-(2-besylethylthio)tetrazol-1-yl]phenyl]-isopropenyl-amine Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)NC1=CC=CC(=C1)N2C(=NN=N2)SCCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=C)NC1=CC=CC(=C1)N2C(=NN=N2)SCCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19N5O2S2/c1-14(2)19-15-7-6-8-16(13-15)23-18(20-21-22-23)26-11-12-27(24,25)17-9-4-3-5-10-17/h3-10,13,19H,1,11-12H2,2H3