N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-2-(1-azanylpentyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-2-(1-azanylpentyl)-1,3-thiazole-4-carboxamide Openeye Name: N-[2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-2-(1-aminopentyl)thiazole-4-carboxamide CAS Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-(1-aminopentyl)-4-thiazolecarboxamide IUPAC Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-(1-aminopentyl)-1,3-thiazole-4-carboxamide Traditional Name: N-[2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-2-(1-aminopentyl)thiazole-4-carboxamide Formula: C20H25N5O2S MolecularWeight: 399.5098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=NC(=CS1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N)N

Isomeric SMILES

CCCCC(C1=NC(=CS1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N)N

InChI

InChI=1S/C20H25N5O2S/c1-2-3-7-14(21)20-25-17(11-28-20)19(27)24-16(18(22)26)9-12-10-23-15-8-5-4-6-13(12)15/h4-6,8,10-11,14,16,23H,2-3,7,9,21H2,1H3,(H2,22,26)(H,24,27)