3-(3-azanylpropyl)-5-[[4-(1-cyclohexylethylcarbamoyl)-1,3-thiazol-2-yl]carbamoyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-(3-azanylpropyl)-5-[[4-(1-cyclohexylethylcarbamoyl)-1,3-thiazol-2-yl]carbamoyl]-1H-indole-2-carboxylic acid Openeye Name: 3-(3-aminopropyl)-5-[[4-(1-cyclohexylethylcarbamoyl)thiazol-2-yl]carbamoyl]-1H-indole-2-carboxylic acid CAS Name: 3-(3-aminopropyl)-5-[[[4-[(1-cyclohexylethylamino)-oxomethyl]-2-thiazolyl]amino]-oxomethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-(3-aminopropyl)-5-[[4-(1-cyclohexylethylcarbamoyl)-1,3-thiazol-2-yl]carbamoyl]-1H-indole-2-carboxylic acid Traditional Name: 3-(3-aminopropyl)-5-[[4-(1-cyclohexylethylcarbamoyl)thiazol-2-yl]carbamoyl]-1H-indole-2-carboxylic acid Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC(=O)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)NC(=C4CCCN)C(=O)O

Isomeric SMILES

CC(C1CCCCC1)NC(=O)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)NC(=C4CCCN)C(=O)O

InChI

InChI=1S/C25H31N5O4S/c1-14(15-6-3-2-4-7-15)27-23(32)20-13-35-25(29-20)30-22(31)16-9-10-19-18(12-16)17(8-5-11-26)21(28-19)24(33)34/h9-10,12-15,28H,2-8,11,26H2,1H3,(H,27,32)(H,33,34)(H,29,30,31)