methyl (2R)-3-(1H-indol-3-yl)-2-[2-[(5-methylthiophen-2-yl)carbonylamino]ethanoylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-[2-[(5-methylthiophen-2-yl)carbonylamino]ethanoylamino]propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[2-[(5-methylthiophene-2-carbonyl)amino]acetyl]amino]propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[2-[[(5-methyl-2-thiophenyl)-oxomethyl]amino]-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[2-[(5-methylthiophene-2-carbonyl)amino]acetyl]amino]propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[[2-[(5-methylthiophene-2-carbonyl)amino]acetyl]amino]propionic acid methyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NCC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=CC=C(S1)C(=O)NCC(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C20H21N3O4S/c1-12-7-8-17(28-12)19(25)22-11-18(24)23-16(20(26)27-2)9-13-10-21-15-6-4-3-5-14(13)15/h3-8,10,16,21H,9,11H2,1-2H3,(H,22,25)(H,23,24)/t16-/m1/s1