1-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC(=CN2)C(=O)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC(=CN2)C(=O)C)C

InChI

InChI=1S/C17H20N4O2S/c1-4-12-7-5-6-10(2)15(12)19-17(24)21-20-16(23)14-8-13(9-18-14)11(3)22/h5-9,18H,4H2,1-3H3,(H,20,23)(H2,19,21,24)