2-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)-3-methylsulfonyl-guanidine

Systemtic Name: 2-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)-3-methylsulfonyl-guanidine Openeye Name: 2-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)-3-methylsulfonyl-guanidine CAS Name: 2-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-(4,6-dimethyl-2-pyrimidinyl)-3-methylsulfonylguanidine IUPAC Name: 2-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)-3-methylsulfonylguanidine Traditional Name: 2-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)-3-mesyl-guanidine Formula: C18H21ClN6O2S MolecularWeight: 420.91634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NS(=O)(=O)C)C

InChI

InChI=1S/C18H21ClN6O2S/c1-11-8-12(2)23-18(22-11)24-17(25-28(3,26)27)20-7-6-13-10-21-16-5-4-14(19)9-15(13)16/h4-5,8-10,21H,6-7H2,1-3H3,(H2,20,22,23,24,25)