4-methyl-N1-[5-[2-(pyridin-4-ylmethoxy)phenyl]-1,3,4-thiadiazol-2-yl]benzene-1,3-diamine

Systemtic Name: 4-methyl-N1-[5-[2-(pyridin-4-ylmethoxy)phenyl]-1,3,4-thiadiazol-2-yl]benzene-1,3-diamine Openeye Name: 4-methyl-N1-[5-[2-(4-pyridylmethoxy)phenyl]-1,3,4-thiadiazol-2-yl]benzene-1,3-diamine CAS Name: 4-methyl-N1-[5-[2-(pyridin-4-ylmethoxy)phenyl]-1,3,4-thiadiazol-2-yl]benzene-1,3-diamine IUPAC Name: 4-methyl-1-N-[5-[2-(pyridin-4-ylmethoxy)phenyl]-1,3,4-thiadiazol-2-yl]benzene-1,3-diamine Traditional Name: (3-amino-4-methyl-phenyl)-[5-[2-(4-pyridylmethoxy)phenyl]-1,3,4-thiadiazol-2-yl]amine Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN=C(S2)C3=CC=CC=C3OCC4=CC=NC=C4)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN=C(S2)C3=CC=CC=C3OCC4=CC=NC=C4)N

InChI

InChI=1S/C21H19N5OS/c1-14-6-7-16(12-18(14)22)24-21-26-25-20(28-21)17-4-2-3-5-19(17)27-13-15-8-10-23-11-9-15/h2-12H,13,22H2,1H3,(H,24,26)