5-(2-methylpropanoylamino)-6-(2-naphthalen-1-ylethyl)-3-thiophen-2-yl-2,3-dihydro-1H-indene-1-carboxylic acid

Systemtic Name: 5-(2-methylpropanoylamino)-6-(2-naphthalen-1-ylethyl)-3-thiophen-2-yl-2,3-dihydro-1H-indene-1-carboxylic acid Openeye Name: 5-(2-methylpropanoylamino)-6-[2-(1-naphthyl)ethyl]-3-(2-thienyl)indane-1-carboxylic acid CAS Name: 5-[(2-methyl-1-oxopropyl)amino]-6-[2-(1-naphthalenyl)ethyl]-3-thiophen-2-yl-2,3-dihydro-1H-indene-1-carboxylic acid IUPAC Name: 5-(2-methylpropanoylamino)-6-(2-naphthalen-1-ylethyl)-3-thiophen-2-yl-2,3-dihydro-1H-indene-1-carboxylic acid Traditional Name: 5-(isobutyrylamino)-6-[2-(1-naphthyl)ethyl]-3-(2-thienyl)indane-1-carboxylic acid Formula: C30H29NO3S MolecularWeight: 483.62116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C2C(CC(C2=C1)C3=CC=CS3)C(=O)O)CCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C2C(CC(C2=C1)C3=CC=CS3)C(=O)O)CCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C30H29NO3S/c1-18(2)29(32)31-27-17-24-23(26(30(33)34)16-25(24)28-11-6-14-35-28)15-21(27)13-12-20-9-5-8-19-7-3-4-10-22(19)20/h3-11,14-15,17-18,25-26H,12-13,16H2,1-2H3,(H,31,32)(H,33,34)