1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]-3-[(1-phenylcyclopropyl)methyl]urea

Systemtic Name: 1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]-3-[(1-phenylcyclopropyl)methyl]urea Openeye Name: 1-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]-3-[(1-phenylcyclopropyl)methyl]urea CAS Name: 1-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-[(1-phenylcyclopropyl)methyl]urea IUPAC Name: 1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]-3-[(1-phenylcyclopropyl)methyl]urea Traditional Name: 1-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]-3-[(1-phenylcyclopropyl)methyl]urea Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)NCC3(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)NCC3(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O2S/c1-14-7-8-17-15(11-14)12-18(27-17)19(25)23-24-20(26)22-13-21(9-10-21)16-5-3-2-4-6-16/h2-6,12,14H,7-11,13H2,1H3,(H,23,25)(H2,22,24,26)