5-[(3-chloranyl-4-methyl-phenyl)amino]-3-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[(3-chloranyl-4-methyl-phenyl)amino]-3-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(3-chloro-4-methyl-anilino)-3-[[2-(3-pyridyl)pyrrolidin-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(3-chloro-4-methylanilino)-3-[[2-(3-pyridinyl)-1-pyrrolidinyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(3-chloro-4-methylanilino)-3-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(3-chloro-4-methyl-anilino)-3-[[2-(3-pyridyl)pyrrolidino]methyl]-1,3,4-thiadiazole-2-thione Formula: C19H20ClN5S2 MolecularWeight: 417.9786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NN(C(=S)S2)CN3CCCC3C4=CN=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NN(C(=S)S2)CN3CCCC3C4=CN=CC=C4)Cl

InChI

InChI=1S/C19H20ClN5S2/c1-13-6-7-15(10-16(13)20)22-18-23-25(19(26)27-18)12-24-9-3-5-17(24)14-4-2-8-21-11-14/h2,4,6-8,10-11,17H,3,5,9,12H2,1H3,(H,22,23)