2-phenethyl-1-(2,4,5-trimethylphenyl)sulfonyl-guanidine

Systemtic Name: 2-phenethyl-1-(2,4,5-trimethylphenyl)sulfonyl-guanidine Openeye Name: 2-phenethyl-1-(2,4,5-trimethylphenyl)sulfonyl-guanidine CAS Name: 2-phenethyl-1-(2,4,5-trimethylphenyl)sulfonylguanidine IUPAC Name: 2-phenethyl-1-(2,4,5-trimethylphenyl)sulfonylguanidine Traditional Name: 2-phenethyl-1-(2,4,5-trimethylphenyl)sulfonyl-guanidine Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)NC(=NCCC2=CC=CC=C2)N)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)NC(=NCCC2=CC=CC=C2)N)C

InChI

InChI=1S/C18H23N3O2S/c1-13-11-15(3)17(12-14(13)2)24(22,23)21-18(19)20-10-9-16-7-5-4-6-8-16/h4-8,11-12H,9-10H2,1-3H3,(H3,19,20,21)