3-(1-benzothiophen-3-yl)-2-(2,3-dihydro-1H-inden-5-ylcarbamoylamino)propanoic acid

Systemtic Name: 3-(1-benzothiophen-3-yl)-2-(2,3-dihydro-1H-inden-5-ylcarbamoylamino)propanoic acid Openeye Name: 3-(benzothiophen-3-yl)-2-(indan-5-ylcarbamoylamino)propanoic acid CAS Name: 3-(1-benzothiophen-3-yl)-2-[[(2,3-dihydro-1H-inden-5-ylamino)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(1-benzothiophen-3-yl)-2-(2,3-dihydro-1H-inden-5-ylcarbamoylamino)propanoic acid Traditional Name: 3-(benzothiophen-3-yl)-2-(indan-5-ylcarbamoylamino)propionic acid Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)NC(CC3=CSC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)NC(CC3=CSC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C21H20N2O3S/c24-20(25)18(11-15-12-27-19-7-2-1-6-17(15)19)23-21(26)22-16-9-8-13-4-3-5-14(13)10-16/h1-2,6-10,12,18H,3-5,11H2,(H,24,25)(H2,22,23,26)