4-[[3-methyl-5-(1,3-thiazol-2-yl)phenyl]methyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde

Systemtic Name: 4-[[3-methyl-5-(1,3-thiazol-2-yl)phenyl]methyl]-3-oxidanylidene-1,4-benzoxazine-6-carbaldehyde Openeye Name: 4-[(3-methyl-5-thiazol-2-yl-phenyl)methyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde CAS Name: 4-[[3-methyl-5-(2-thiazolyl)phenyl]methyl]-3-oxo-1,4-benzoxazine-6-carboxaldehyde IUPAC Name: 4-[[3-methyl-5-(1,3-thiazol-2-yl)phenyl]methyl]-3-oxo-1,4-benzoxazine-6-carbaldehyde Traditional Name: 3-keto-4-(3-methyl-5-thiazol-2-yl-benzyl)-1,4-benzoxazine-6-carbaldehyde Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=NC=CS2)CN3C(=O)COC4=C3C=C(C=C4)C=O

Isomeric SMILES

CC1=CC(=CC(=C1)C2=NC=CS2)CN3C(=O)COC4=C3C=C(C=C4)C=O

InChI

InChI=1S/C20H16N2O3S/c1-13-6-15(8-16(7-13)20-21-4-5-26-20)10-22-17-9-14(11-23)2-3-18(17)25-12-19(22)24/h2-9,11H,10,12H2,1H3