1-(4-butylphenyl)-3-(pyridin-4-ylcarbonylamino)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(pyridin-4-ylcarbonylamino)thiourea Openeye Name: 1-(4-butylphenyl)-3-(pyridine-4-carbonylamino)thiourea CAS Name: 1-(4-butylphenyl)-3-[[oxo(pyridin-4-yl)methyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-(pyridine-4-carbonylamino)thiourea Traditional Name: 1-(4-butylphenyl)-3-isonicotinamido-thiourea Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=NC=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC=NC=C2

InChI

InChI=1S/C17H20N4OS/c1-2-3-4-13-5-7-15(8-6-13)19-17(23)21-20-16(22)14-9-11-18-12-10-14/h5-12H,2-4H2,1H3,(H,20,22)(H2,19,21,23)