1-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-ylcarbonylamino)-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-(indane-5-carbonylamino)thiourea CAS Name: 1-[[2,3-dihydro-1H-inden-5-yl(oxo)methyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-(2,3-dihydro-1H-indene-5-carbonylamino)-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-(indane-5-carbonylamino)thiourea Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC3=C(CCC3)C=C2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC3=C(CCC3)C=C2)C

InChI

InChI=1S/C20H23N3OS/c1-3-14-7-4-6-13(2)18(14)21-20(25)23-22-19(24)17-11-10-15-8-5-9-16(15)12-17/h4,6-7,10-12H,3,5,8-9H2,1-2H3,(H,22,24)(H2,21,23,25)