N-(3-methoxypropyl)-2-[3-(1-phenylpyrazol-4-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(3-methoxypropyl)-2-[3-(1-phenylpyrazol-4-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(3-methoxypropyl)-2-[3-(1-phenylpyrazol-4-yl)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(3-methoxypropyl)-2-[[1-oxo-3-(1-phenyl-4-pyrazolyl)propyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(3-methoxypropyl)-2-[3-(1-phenylpyrazol-4-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(3-methoxypropyl)-2-[3-(1-phenylpyrazol-4-yl)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

COCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O3S/c1-32-15-7-14-26-24(31)23-20-10-5-6-11-21(20)33-25(23)28-22(30)13-12-18-16-27-29(17-18)19-8-3-2-4-9-19/h2-4,8-9,16-17H,5-7,10-15H2,1H3,(H,26,31)(H,28,30)