1-(4-methylphenyl)sulfonyl-2-(phenylmethyl)-3-prop-2-ynyl-guanidine

Systemtic Name: 1-(4-methylphenyl)sulfonyl-2-(phenylmethyl)-3-prop-2-ynyl-guanidine Openeye Name: 2-benzyl-1-prop-2-ynyl-3-(p-tolylsulfonyl)guanidine CAS Name: 1-(4-methylphenyl)sulfonyl-2-(phenylmethyl)-3-prop-2-ynylguanidine IUPAC Name: 2-benzyl-1-(4-methylphenyl)sulfonyl-3-prop-2-ynylguanidine Traditional Name: 2-benzyl-1-propargyl-3-tosyl-guanidine Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCC2=CC=CC=C2)NCC#C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCC2=CC=CC=C2)NCC#C

InChI

InChI=1S/C18H19N3O2S/c1-3-13-19-18(20-14-16-7-5-4-6-8-16)21-24(22,23)17-11-9-15(2)10-12-17/h1,4-12H,13-14H2,2H3,(H2,19,20,21)