1-(2-ethyl-6-methyl-phenyl)-3-[(1-methylpyrrol-2-yl)methyl]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1-methylpyrrol-2-yl)methyl]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1-methylpyrrol-2-yl)methyl]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[(1-methyl-2-pyrrolyl)methyl]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[(1-methylpyrrol-2-yl)methyl]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1-methylpyrrol-2-yl)methyl]thiourea Formula: C16H21N3S MolecularWeight: 287.42304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NCC2=CC=CN2C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NCC2=CC=CN2C)C

InChI

InChI=1S/C16H21N3S/c1-4-13-8-5-7-12(2)15(13)18-16(20)17-11-14-9-6-10-19(14)3/h5-10H,4,11H2,1-3H3,(H2,17,18,20)