1-cyano-3-[3-[(4-ethylphenyl)sulfonylamino]-2-oxidanyl-2,3-dihydro-1H-inden-5-yl]-2-phenethyl-guanidine

Systemtic Name: 1-cyano-3-[3-[(4-ethylphenyl)sulfonylamino]-2-oxidanyl-2,3-dihydro-1H-inden-5-yl]-2-phenethyl-guanidine Openeye Name: 1-cyano-3-[3-[(4-ethylphenyl)sulfonylamino]-2-hydroxy-indan-5-yl]-2-phenethyl-guanidine CAS Name: 1-cyano-3-[3-[(4-ethylphenyl)sulfonylamino]-2-hydroxy-2,3-dihydro-1H-inden-5-yl]-2-phenethylguanidine IUPAC Name: 1-cyano-3-[3-[(4-ethylphenyl)sulfonylamino]-2-hydroxy-2,3-dihydro-1H-inden-5-yl]-2-phenethylguanidine Traditional Name: 1-cyano-3-[3-[(4-ethylphenyl)sulfonylamino]-2-hydroxy-indan-5-yl]-2-phenethyl-guanidine Formula: C27H29N5O3S MolecularWeight: 503.61586

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC2C(CC3=C2C=C(C=C3)NC(=NCCC4=CC=CC=C4)NC#N)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NC2C(CC3=C2C=C(C=C3)NC(=NCCC4=CC=CC=C4)NC#N)O

InChI

InChI=1S/C27H29N5O3S/c1-2-19-8-12-23(13-9-19)36(34,35)32-26-24-17-22(11-10-21(24)16-25(26)33)31-27(30-18-28)29-15-14-20-6-4-3-5-7-20/h3-13,17,25-26,32-33H,2,14-16H2,1H3,(H2,29,30,31)