1-(2-chloranyl-4,6-dimethyl-phenyl)-3-(1H-pyrrol-2-ylcarbonylamino)thiourea

Systemtic Name: 1-(2-chloranyl-4,6-dimethyl-phenyl)-3-(1H-pyrrol-2-ylcarbonylamino)thiourea Openeye Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-(1H-pyrrole-2-carbonylamino)thiourea CAS Name: 1-(2-chloro-4,6-dimethylphenyl)-3-[[oxo(1H-pyrrol-2-yl)methyl]amino]thiourea IUPAC Name: 1-(2-chloro-4,6-dimethylphenyl)-3-(1H-pyrrole-2-carbonylamino)thiourea Traditional Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-(1H-pyrrole-2-carbonylamino)thiourea Formula: C14H15ClN4OS MolecularWeight: 322.8131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)NNC(=O)C2=CC=CN2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)NNC(=O)C2=CC=CN2)C

InChI

InChI=1S/C14H15ClN4OS/c1-8-6-9(2)12(10(15)7-8)17-14(21)19-18-13(20)11-4-3-5-16-11/h3-7,16H,1-2H3,(H,18,20)(H2,17,19,21)