1-(4-methylcyclohexa-1,3-dien-1-yl)-3-(pyridin-3-ylcarbonylamino)thiourea

Systemtic Name: 1-(4-methylcyclohexa-1,3-dien-1-yl)-3-(pyridin-3-ylcarbonylamino)thiourea Openeye Name: 1-(4-methylcyclohexa-1,3-dien-1-yl)-3-(pyridine-3-carbonylamino)thiourea CAS Name: 1-(4-methyl-1-cyclohexa-1,3-dienyl)-3-[[oxo(3-pyridinyl)methyl]amino]thiourea IUPAC Name: 1-(4-methylcyclohexa-1,3-dien-1-yl)-3-(pyridine-3-carbonylamino)thiourea Traditional Name: 1-(4-methylcyclohexa-1,3-dien-1-yl)-3-nicotinamido-thiourea Formula: C14H16N4OS MolecularWeight: 288.36804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(CC1)NC(=S)NNC(=O)C2=CN=CC=C2

Isomeric SMILES

CC1=CC=C(CC1)NC(=S)NNC(=O)C2=CN=CC=C2

InChI

InChI=1S/C14H16N4OS/c1-10-4-6-12(7-5-10)16-14(20)18-17-13(19)11-3-2-8-15-9-11/h2-4,6,8-9H,5,7H2,1H3,(H,17,19)(H2,16,18,20)