1-(3-methylphenyl)-3-[2-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)ethyl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[2-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)ethyl]urea Openeye Name: 1-(m-tolyl)-3-[2-(4,5,6,7-tetrahydrobenzothiophen-3-yl)ethyl]urea CAS Name: 1-(3-methylphenyl)-3-[2-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)ethyl]urea IUPAC Name: 1-(3-methylphenyl)-3-[2-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)ethyl]urea Traditional Name: 1-(m-tolyl)-3-[2-(4,5,6,7-tetrahydrobenzothiophen-3-yl)ethyl]urea Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCCC2=CSC3=C2CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCCC2=CSC3=C2CCCC3

InChI

InChI=1S/C18H22N2OS/c1-13-5-4-6-15(11-13)20-18(21)19-10-9-14-12-22-17-8-3-2-7-16(14)17/h4-6,11-12H,2-3,7-10H2,1H3,(H2,19,20,21)