N-[(4-morpholin-4-ylphenyl)carbamothioyl]-4-phenoxy-butanamide

Systemtic Name: N-[(4-morpholin-4-ylphenyl)carbamothioyl]-4-phenoxy-butanamide Openeye Name: N-[(4-morpholinophenyl)carbamothioyl]-4-phenoxy-butanamide CAS Name: N-[[4-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-phenoxybutanamide IUPAC Name: N-[(4-morpholin-4-ylphenyl)carbamothioyl]-4-phenoxybutanamide Traditional Name: N-[(4-morpholinophenyl)thiocarbamoyl]-4-phenoxy-butyramide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=CC=CC=C3

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3S/c25-20(7-4-14-27-19-5-2-1-3-6-19)23-21(28)22-17-8-10-18(11-9-17)24-12-15-26-16-13-24/h1-3,5-6,8-11H,4,7,12-16H2,(H2,22,23,25,28)