ethyl 3-[1-[4-(5-azanyl-6-methyl-1H-inden-2-yl)butanoyl]pyrrolidin-2-yl]carbonyl-4-sulfanylidene-pyrrolidine-2-carboxylate

Systemtic Name: ethyl 3-[1-[4-(5-azanyl-6-methyl-1H-inden-2-yl)butanoyl]pyrrolidin-2-yl]carbonyl-4-sulfanylidene-pyrrolidine-2-carboxylate Openeye Name: ethyl 3-[1-[4-(5-amino-6-methyl-1H-inden-2-yl)butanoyl]pyrrolidine-2-carbonyl]-4-thioxo-pyrrolidine-2-carboxylate CAS Name: 3-[[1-[4-(5-amino-6-methyl-1H-inden-2-yl)-1-oxobutyl]-2-pyrrolidinyl]-oxomethyl]-4-sulfanylidene-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[1-[4-(5-amino-6-methyl-1H-inden-2-yl)butanoyl]pyrrolidine-2-carbonyl]-4-sulfanylidenepyrrolidine-2-carboxylate Traditional Name: 3-[1-[4-(5-amino-6-methyl-1H-inden-2-yl)butanoyl]prolyl]-4-thioxo-pyrrolidine-2-carboxylic acid ethyl ester Formula: C26H33N3O4S MolecularWeight: 483.62292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=S)CN1)C(=O)C2CCCN2C(=O)CCCC3=CC4=CC(=C(C=C4C3)C)N

Isomeric SMILES

CCOC(=O)C1C(C(=S)CN1)C(=O)C2CCCN2C(=O)CCCC3=CC4=CC(=C(C=C4C3)C)N

InChI

InChI=1S/C26H33N3O4S/c1-3-33-26(32)24-23(21(34)14-28-24)25(31)20-7-5-9-29(20)22(30)8-4-6-16-11-17-10-15(2)19(27)13-18(17)12-16/h10,12-13,20,23-24,28H,3-9,11,14,27H2,1-2H3