N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]butanamide

Systemtic Name: N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]butanamide Openeye Name: N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]butanamide CAS Name: N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]butanamide Traditional Name: N-[[4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]butyramide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NC1=CC=C(C=C1)C2=NC3=CC(=CC(=C3O2)C)C

Isomeric SMILES

CCCC(=O)NC(=S)NC1=CC=C(C=C1)C2=NC3=CC(=CC(=C3O2)C)C

InChI

InChI=1S/C20H21N3O2S/c1-4-5-17(24)23-20(26)21-15-8-6-14(7-9-15)19-22-16-11-12(2)10-13(3)18(16)25-19/h6-11H,4-5H2,1-3H3,(H2,21,23,24,26)