2-[(4-butylphenyl)carbamothioylamino]benzamide

Systemtic Name: 2-[(4-butylphenyl)carbamothioylamino]benzamide Openeye Name: 2-[(4-butylphenyl)carbamothioylamino]benzamide CAS Name: 2-[[(4-butylanilino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: 2-[(4-butylphenyl)carbamothioylamino]benzamide Traditional Name: 2-[(4-butylphenyl)thiocarbamoylamino]benzamide Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C(=O)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C18H21N3OS/c1-2-3-6-13-9-11-14(12-10-13)20-18(23)21-16-8-5-4-7-15(16)17(19)22/h4-5,7-12H,2-3,6H2,1H3,(H2,19,22)(H2,20,21,23)