2-(1,3-benzoxazol-2-ylsulfanyl)-N-[[5-bromanyl-1-(morpholin-4-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[[5-bromanyl-1-(morpholin-4-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[[5-bromo-1-(morpholinomethyl)-2-oxo-indolin-3-ylidene]amino]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[[5-bromo-1-(4-morpholinylmethyl)-2-oxo-3-indolylidene]amino]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[[5-bromo-1-(morpholin-4-ylmethyl)-2-oxoindol-3-ylidene]amino]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[[5-bromo-2-keto-1-(morpholinomethyl)indolin-3-ylidene]amino]acetamide Formula: C22H20BrN5O4S MolecularWeight: 530.3943

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CN2C3=C(C=C(C=C3)Br)C(=NNC(=O)CSC4=NC5=CC=CC=C5O4)C2=O

Isomeric SMILES

C1COCCN1CN2C3=C(C=C(C=C3)Br)C(=NNC(=O)CSC4=NC5=CC=CC=C5O4)C2=O

InChI

InChI=1S/C22H20BrN5O4S/c23-14-5-6-17-15(11-14)20(21(30)28(17)13-27-7-9-31-10-8-27)26-25-19(29)12-33-22-24-16-3-1-2-4-18(16)32-22/h1-6,11H,7-10,12-13H2,(H,25,29)