4-bromanyl-6-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-bromanyl-6-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-bromo-6-[5-(2-morpholino-2-oxo-ethyl)sulfanyl-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 4-bromo-6-[5-[[2-(4-morpholinyl)-2-oxoethyl]thio]-1,2-dihydro-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-bromo-6-[5-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-bromo-6-[5-[(2-keto-2-morpholino-ethyl)thio]-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C14H15BrN4O3S MolecularWeight: 399.2629

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NC(=C3C=C(C=CC3=O)Br)NN2

Isomeric SMILES

C1COCCN1C(=O)CSC2=NC(=C3C=C(C=CC3=O)Br)NN2

InChI

InChI=1S/C14H15BrN4O3S/c15-9-1-2-11(20)10(7-9)13-16-14(18-17-13)23-8-12(21)19-3-5-22-6-4-19/h1-2,7,17H,3-6,8H2,(H,16,18)