1-(4-chlorophenyl)-3-cyano-2-(2,2-dimethyl-3-oxidanyl-6-pyrrolidin-1-ylsulfonyl-3,4-dihydrochromen-4-yl)guanidine

Systemtic Name: 1-(4-chlorophenyl)-3-cyano-2-(2,2-dimethyl-3-oxidanyl-6-pyrrolidin-1-ylsulfonyl-3,4-dihydrochromen-4-yl)guanidine Openeye Name: 1-(4-chlorophenyl)-3-cyano-2-(3-hydroxy-2,2-dimethyl-6-pyrrolidin-1-ylsulfonyl-chroman-4-yl)guanidine CAS Name: 1-(4-chlorophenyl)-3-cyano-2-[3-hydroxy-2,2-dimethyl-6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-1-benzopyran-4-yl]guanidine IUPAC Name: 1-(4-chlorophenyl)-3-cyano-2-(3-hydroxy-2,2-dimethyl-6-pyrrolidin-1-ylsulfonyl-3,4-dihydrochromen-4-yl)guanidine Traditional Name: 1-(4-chlorophenyl)-3-cyano-2-(3-hydroxy-2,2-dimethyl-6-pyrrolidinosulfonyl-chroman-4-yl)guanidine Formula: C23H26ClN5O4S MolecularWeight: 504.00164

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)S(=O)(=O)N3CCCC3)N=C(NC#N)NC4=CC=C(C=C4)Cl)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)S(=O)(=O)N3CCCC3)N=C(NC#N)NC4=CC=C(C=C4)Cl)O)C

InChI

InChI=1S/C23H26ClN5O4S/c1-23(2)21(30)20(28-22(26-14-25)27-16-7-5-15(24)6-8-16)18-13-17(9-10-19(18)33-23)34(31,32)29-11-3-4-12-29/h5-10,13,20-21,30H,3-4,11-12H2,1-2H3,(H2,26,27,28)