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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N5O2S/c1-11(2)7-14(21)20-25-17(10-28-20)19(27)24-16(18(22)26)8-12-9-23-15-6-4-3-5-13(12)15/h3-6,9-11,14,16,23H,7-8,21H2,1-2H3,(H2,22,26)(H,24,27)