N-(3-chloranyl-4-morpholin-4-yl-phenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-4-morpholin-4-yl-phenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-chloro-4-morpholino-phenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[3-chloro-4-(4-morpholinyl)phenyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-chloro-4-morpholin-4-ylphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-chloro-4-morpholino-phenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H20ClN5O2S MolecularWeight: 429.9231

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)NC(=O)CSC3=NN(C=N3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)NC(=O)CSC3=NN(C=N3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C20H20ClN5O2S/c21-17-12-15(6-7-18(17)25-8-10-28-11-9-25)23-19(27)13-29-20-22-14-26(24-20)16-4-2-1-3-5-16/h1-7,12,14H,8-11,13H2,(H,23,27)