butyl 3-(1H-indol-3-yl)-2-[(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)carbonylamino]propanoate

Systemtic Name: butyl 3-(1H-indol-3-yl)-2-[(2-pyrrolidin-2-yl-1,3-thiazol-4-yl)carbonylamino]propanoate Openeye Name: butyl 3-(1H-indol-3-yl)-2-[(2-pyrrolidin-2-ylthiazole-4-carbonyl)amino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[oxo-[2-(2-pyrrolidinyl)-4-thiazolyl]methyl]amino]propanoic acid butyl ester IUPAC Name: butyl 3-(1H-indol-3-yl)-2-[(2-pyrrolidin-2-yl-1,3-thiazole-4-carbonyl)amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[(2-pyrrolidin-2-ylthiazole-4-carbonyl)amino]propionic acid butyl ester Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CSC(=N3)C4CCCN4

Isomeric SMILES

CCCCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CSC(=N3)C4CCCN4

InChI

InChI=1S/C23H28N4O3S/c1-2-3-11-30-23(29)19(12-15-13-25-17-8-5-4-7-16(15)17)26-21(28)20-14-31-22(27-20)18-9-6-10-24-18/h4-5,7-8,13-14,18-19,24-25H,2-3,6,9-12H2,1H3,(H,26,28)