5-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-N-pyridin-3-yl-6H-1,3,4-thiadiazin-2-amine

Systemtic Name: 5-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-N-pyridin-3-yl-6H-1,3,4-thiadiazin-2-amine Openeye Name: 5-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-N-(3-pyridyl)-6H-1,3,4-thiadiazin-2-amine CAS Name: 5-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-N-(3-pyridinyl)-6H-1,3,4-thiadiazin-2-amine IUPAC Name: 5-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-N-pyridin-3-yl-6H-1,3,4-thiadiazin-2-amine Traditional Name: [5-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-6H-1,3,4-thiadiazin-2-yl]-(3-pyridyl)amine Formula: C22H23N5S MolecularWeight: 389.51652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C3=NN=C(SC3)NC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C3=NN=C(SC3)NC4=CN=CC=C4

InChI

InChI=1S/C22H23N5S/c1-16-13-20(17(2)27(16)12-10-18-7-4-3-5-8-18)21-15-28-22(26-25-21)24-19-9-6-11-23-14-19/h3-9,11,13-14H,10,12,15H2,1-2H3,(H,24,26)