2-[3-(1H-indol-3-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[3-(1H-indol-3-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[3-(1H-indol-3-yl)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[3-(1H-indol-3-yl)-1-oxopropyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[3-(1H-indol-3-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[3-(1H-indol-3-yl)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CCC3=CNC4=CC=CC=C43)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CCC3=CNC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C20H21N3O2S/c21-19(25)18-14-6-2-4-8-16(14)26-20(18)23-17(24)10-9-12-11-22-15-7-3-1-5-13(12)15/h1,3,5,7,11,22H,2,4,6,8-10H2,(H2,21,25)(H,23,24)