1-[(2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-yl)sulfonyl]-2-phenethyl-guanidine

Systemtic Name: 1-[(2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-yl)sulfonyl]-2-phenethyl-guanidine Openeye Name: 1-(2,2,5,7,8-pentamethylchroman-6-yl)sulfonyl-2-phenethyl-guanidine CAS Name: 1-[(2,2,5,7,8-pentamethyl-3,4-dihydro-2H-1-benzopyran-6-yl)sulfonyl]-2-phenethylguanidine IUPAC Name: 1-[(2,2,5,7,8-pentamethyl-3,4-dihydrochromen-6-yl)sulfonyl]-2-phenethylguanidine Traditional Name: 1-(2,2,5,7,8-pentamethylchroman-6-yl)sulfonyl-2-phenethyl-guanidine Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)S(=O)(=O)NC(=NCCC3=CC=CC=C3)N)C)CCC(O2)(C)C

Isomeric SMILES

CC1=C2C(=C(C(=C1C)S(=O)(=O)NC(=NCCC3=CC=CC=C3)N)C)CCC(O2)(C)C

InChI

InChI=1S/C23H31N3O3S/c1-15-16(2)21(17(3)19-11-13-23(4,5)29-20(15)19)30(27,28)26-22(24)25-14-12-18-9-7-6-8-10-18/h6-10H,11-14H2,1-5H3,(H3,24,25,26)