1-[(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1-isopropyl-2,5-dimethyl-pyrrole-3-carbonyl)amino]thiourea CAS Name: 1-[[(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-oxomethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[(2,5-dimethyl-1-propan-2-ylpyrrole-3-carbonyl)amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1-isopropyl-2,5-dimethyl-pyrrole-3-carbonyl)amino]thiourea Formula: C20H28N4OS MolecularWeight: 372.52752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4OS/c1-7-16-10-8-9-13(4)18(16)21-20(26)23-22-19(25)17-11-14(5)24(12(2)3)15(17)6/h8-12H,7H2,1-6H3,(H,22,25)(H2,21,23,26)