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

Systemtic Name: N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-2-(1-azanyl-3-methylsulfanyl-propyl)-1,3-thiazole-4-carboxamide Openeye Name: N-[2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-2-(1-amino-3-methylsulfanyl-propyl)thiazole-4-carboxamide CAS Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[1-amino-3-(methylthio)propyl]-4-thiazolecarboxamide IUPAC Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-(1-amino-3-methylsulfanylpropyl)-1,3-thiazole-4-carboxamide Traditional Name: N-[2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-2-[1-amino-3-(methylthio)propyl]thiazole-4-carboxamide Formula: C19H23N5O2S2 MolecularWeight: 417.54822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N5O2S2/c1-27-7-6-13(20)19-24-16(10-28-19)18(26)23-15(17(21)25)8-11-9-22-14-5-3-2-4-12(11)14/h2-5,9-10,13,15,22H,6-8,20H2,1H3,(H2,21,25)(H,23,26)