1-(benzotriazol-1-yl)-N-[(4-methylphenyl)sulfonylmethyl]-1-pyrrolidin-1-yl-methanimine

Systemtic Name: 1-(benzotriazol-1-yl)-N-[(4-methylphenyl)sulfonylmethyl]-1-pyrrolidin-1-yl-methanimine Openeye Name: 1-(benzotriazol-1-yl)-N-(p-tolylsulfonylmethyl)-1-pyrrolidin-1-yl-methanimine CAS Name: 1-(1-benzotriazolyl)-N-[(4-methylphenyl)sulfonylmethyl]-1-(1-pyrrolidinyl)methanimine IUPAC Name: 1-(benzotriazol-1-yl)-N-[(4-methylphenyl)sulfonylmethyl]-1-pyrrolidin-1-ylmethanimine Traditional Name: (E)-[benzotriazol-1-yl(pyrrolidino)methylene]-(tosylmethyl)amine Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CN=C(N2CCCC2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C/N=C(\N2CCCC2)/N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C19H21N5O2S/c1-15-8-10-16(11-9-15)27(25,26)14-20-19(23-12-4-5-13-23)24-18-7-3-2-6-17(18)21-22-24/h2-3,6-11H,4-5,12-14H2,1H3/b20-19+