1-[(2-oxidanyl-2-propyl-pentanoyl)amino]-1-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)urea

Systemtic Name: 1-[(2-oxidanyl-2-propyl-pentanoyl)amino]-1-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)urea Openeye Name: 1-[(2-hydroxy-2-propyl-pentanoyl)amino]-1-phenyl-3-(4,5,6,7-tetrahydrobenzothiophen-3-yl)urea CAS Name: 1-[(2-hydroxy-1-oxo-2-propylpentyl)amino]-1-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)urea IUPAC Name: 1-[(2-hydroxy-2-propylpentanoyl)amino]-1-phenyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)urea Traditional Name: 1-[(2-hydroxy-2-propyl-pentanoyl)amino]-1-phenyl-3-(4,5,6,7-tetrahydrobenzothiophen-3-yl)urea Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C(=O)NN(C1=CC=CC=C1)C(=O)NC2=CSC3=C2CCCC3)O

Isomeric SMILES

CCCC(CCC)(C(=O)NN(C1=CC=CC=C1)C(=O)NC2=CSC3=C2CCCC3)O

InChI

InChI=1S/C23H31N3O3S/c1-3-14-23(29,15-4-2)21(27)25-26(17-10-6-5-7-11-17)22(28)24-19-16-30-20-13-9-8-12-18(19)20/h5-7,10-11,16,29H,3-4,8-9,12-15H2,1-2H3,(H,24,28)(H,25,27)