1-(butanoylamino)-3-(3-chloranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-(butanoylamino)-3-(3-chloranyl-4-methyl-phenyl)thiourea Openeye Name: 1-(butanoylamino)-3-(3-chloro-4-methyl-phenyl)thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-(1-oxobutylamino)thiourea IUPAC Name: 1-(butanoylamino)-3-(3-chloro-4-methylphenyl)thiourea Traditional Name: 1-butyramido-3-(3-chloro-4-methyl-phenyl)thiourea Formula: C12H16ClN3OS MolecularWeight: 285.79294

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NNC(=S)NC1=CC(=C(C=C1)C)Cl

Isomeric SMILES

CCCC(=O)NNC(=S)NC1=CC(=C(C=C1)C)Cl

InChI

InChI=1S/C12H16ClN3OS/c1-3-4-11(17)15-16-12(18)14-9-6-5-8(2)10(13)7-9/h5-7H,3-4H2,1-2H3,(H,15,17)(H2,14,16,18)