methyl N-[[2-(butanoylamino)-4-phenoxy-phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-(butanoylamino)-4-phenoxy-phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-(butanoylamino)-4-phenoxy-phenyl]carbamothioyl]carbamate CAS Name: N-[[2-(1-oxobutylamino)-4-phenoxyanilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(butanoylamino)-4-phenoxyphenyl]carbamothioyl]carbamate Traditional Name: N-[(2-butyramido-4-phenoxy-phenyl)thiocarbamoyl]carbamic acid methyl ester Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=CC(=C1)OC2=CC=CC=C2)NC(=S)NC(=O)OC

Isomeric SMILES

CCCC(=O)NC1=C(C=CC(=C1)OC2=CC=CC=C2)NC(=S)NC(=O)OC

InChI

InChI=1S/C19H21N3O4S/c1-3-7-17(23)20-16-12-14(26-13-8-5-4-6-9-13)10-11-15(16)21-18(27)22-19(24)25-2/h4-6,8-12H,3,7H2,1-2H3,(H,20,23)(H2,21,22,24,27)