[5-azanyl-3-[[3-chloranyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]amino]-1,2,4-triazol-1-yl]-[3,5-bis(chloranyl)phenyl]methanone

Systemtic Name: [5-azanyl-3-[[3-chloranyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]amino]-1,2,4-triazol-1-yl]-[3,5-bis(chloranyl)phenyl]methanone Openeye Name: [5-amino-3-[3-chloro-4-(2-pyrrolidin-1-ylethoxy)anilino]-1,2,4-triazol-1-yl]-(3,5-dichlorophenyl)methanone CAS Name: [5-amino-3-[3-chloro-4-[2-(1-pyrrolidinyl)ethoxy]anilino]-1,2,4-triazol-1-yl]-(3,5-dichlorophenyl)methanone IUPAC Name: [5-amino-3-[3-chloro-4-(2-pyrrolidin-1-ylethoxy)anilino]-1,2,4-triazol-1-yl]-(3,5-dichlorophenyl)methanone Traditional Name: [5-amino-3-[3-chloro-4-(2-pyrrolidinoethoxy)anilino]-1,2,4-triazol-1-yl]-(3,5-dichlorophenyl)methanone Formula: C21H21Cl3N6O2 MolecularWeight: 495.78944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=C(C=C(C=C2)NC3=NN(C(=N3)N)C(=O)C4=CC(=CC(=C4)Cl)Cl)Cl

Isomeric SMILES

C1CCN(C1)CCOC2=C(C=C(C=C2)NC3=NN(C(=N3)N)C(=O)C4=CC(=CC(=C4)Cl)Cl)Cl

InChI

InChI=1S/C21H21Cl3N6O2/c22-14-9-13(10-15(23)11-14)19(31)30-20(25)27-21(28-30)26-16-3-4-18(17(24)12-16)32-8-7-29-5-1-2-6-29/h3-4,9-12H,1-2,5-8H2,(H3,25,26,27,28)