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

Systemtic Name: N-[[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]butanamide Openeye Name: N-[[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]butanamide CAS Name: N-[[4-(5-methyl-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]butanamide Traditional Name: N-[[4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]butyramide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C

Isomeric SMILES

CCCC(=O)NC(=S)NC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C

InChI

InChI=1S/C19H19N3O2S/c1-3-4-17(23)22-19(25)20-14-8-6-13(7-9-14)18-21-15-11-12(2)5-10-16(15)24-18/h5-11H,3-4H2,1-2H3,(H2,20,22,23,25)