N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-[(4-propan-2-yl-1,3-thiazol-2-yl)amino]propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxidanylidene-1-[(4-propan-2-yl-1,3-thiazol-2-yl)amino]propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-[(4-isopropylthiazol-2-yl)amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-[(4-propan-2-yl-2-thiazolyl)amino]propan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-3-(1H-indol-3-yl)-1-oxo-1-[(4-propan-2-yl-1,3-thiazol-2-yl)amino]propan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-[(4-isopropylthiazol-2-yl)amino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C22H22N4O2S2 MolecularWeight: 438.56568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4

Isomeric SMILES

CC(C)C1=CSC(=N1)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H22N4O2S2/c1-13(2)18-12-30-22(25-18)26-20(27)17(24-21(28)19-8-5-9-29-19)10-14-11-23-16-7-4-3-6-15(14)16/h3-9,11-13,17,23H,10H2,1-2H3,(H,24,28)(H,25,26,27)/t17-/m0/s1