[aminocarbonyl-[4-[5-[(4-fluorophenyl)methyl]thiophen-2-yl]but-3-yn-2-yl]amino] 5-chloranyl-6-phenyl-2,3-dihydro-1H-indene-2-carboxylate

Systemtic Name: [aminocarbonyl-[4-[5-[(4-fluorophenyl)methyl]thiophen-2-yl]but-3-yn-2-yl]amino] 5-chloranyl-6-phenyl-2,3-dihydro-1H-indene-2-carboxylate Openeye Name: [carbamoyl-[3-[5-[(4-fluorophenyl)methyl]-2-thienyl]-1-methyl-prop-2-ynyl]amino] 5-chloro-6-phenyl-indane-2-carboxylate CAS Name: 5-chloro-6-phenyl-2,3-dihydro-1H-indene-2-carboxylic acid [carbamoyl-[4-[5-[(4-fluorophenyl)methyl]-2-thiophenyl]but-3-yn-2-yl]amino] ester IUPAC Name: [carbamoyl-[4-[5-[(4-fluorophenyl)methyl]thiophen-2-yl]but-3-yn-2-yl]amino] 5-chloro-6-phenyl-2,3-dihydro-1H-indene-2-carboxylate Traditional Name: 5-chloro-6-phenyl-indane-2-carboxylic acid [carbamoyl-[3-[5-(4-fluorobenzyl)-2-thienyl]-1-methyl-prop-2-ynyl]amino] ester Formula: C32H26ClFN2O3S MolecularWeight: 573.076843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=C(S1)CC2=CC=C(C=C2)F)N(C(=O)N)OC(=O)C3CC4=C(C3)C=C(C(=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

CC(C#CC1=CC=C(S1)CC2=CC=C(C=C2)F)N(C(=O)N)OC(=O)C3CC4=C(C3)C=C(C(=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C32H26ClFN2O3S/c1-20(7-12-27-13-14-28(40-27)15-21-8-10-26(34)11-9-21)36(32(35)38)39-31(37)25-16-23-18-29(22-5-3-2-4-6-22)30(33)19-24(23)17-25/h2-6,8-11,13-14,18-20,25H,15-17H2,1H3,(H2,35,38)