(3E)-6-chloranyl-3-[2-(3-methyl-5-phenyl-thiophen-2-yl)-2-oxidanylidene-ethylidene]-4H-1,4-benzoxazin-2-one

Systemtic Name: (3E)-6-chloranyl-3-[2-(3-methyl-5-phenyl-thiophen-2-yl)-2-oxidanylidene-ethylidene]-4H-1,4-benzoxazin-2-one Openeye Name: (3E)-6-chloro-3-[2-(3-methyl-5-phenyl-2-thienyl)-2-oxo-ethylidene]-4H-1,4-benzoxazin-2-one CAS Name: (3E)-6-chloro-3-[2-(3-methyl-5-phenyl-2-thiophenyl)-2-oxoethylidene]-4H-1,4-benzoxazin-2-one IUPAC Name: (3E)-6-chloro-3-[2-(3-methyl-5-phenylthiophen-2-yl)-2-oxoethylidene]-4H-1,4-benzoxazin-2-one Traditional Name: (3E)-6-chloro-3-[2-keto-2-(3-methyl-5-phenyl-2-thienyl)ethylidene]-4H-1,4-benzoxazin-2-one Formula: C21H14ClNO3S MolecularWeight: 395.85876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C2=CC=CC=C2)C(=O)C=C3C(=O)OC4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CC1=C(SC(=C1)C2=CC=CC=C2)C(=O)/C=C/3\C(=O)OC4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C21H14ClNO3S/c1-12-9-19(13-5-3-2-4-6-13)27-20(12)17(24)11-16-21(25)26-18-8-7-14(22)10-15(18)23-16/h2-11,23H,1H3/b16-11+