2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[4-(4-chloro-2-methylphenoxy)butanoylamino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H29ClN2O3S MolecularWeight: 449.00596

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C23H29ClN2O3S/c1-3-5-15-7-9-17-19(13-15)30-23(21(17)22(25)28)26-20(27)6-4-11-29-18-10-8-16(24)12-14(18)2/h8,10,12,15H,3-7,9,11,13H2,1-2H3,(H2,25,28)(H,26,27)