4,7-dimethoxy-N-[(2S)-1-oxidanylidene-3-phenyl-1-(1,3-thiazol-2-ylamino)propan-2-yl]-1H-indole-2-carboxamide

Systemtic Name: 4,7-dimethoxy-N-[(2S)-1-oxidanylidene-3-phenyl-1-(1,3-thiazol-2-ylamino)propan-2-yl]-1H-indole-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-(thiazol-2-ylamino)ethyl]-4,7-dimethoxy-1H-indole-2-carboxamide CAS Name: 4,7-dimethoxy-N-[(2S)-1-oxo-3-phenyl-1-(2-thiazolylamino)propan-2-yl]-1H-indole-2-carboxamide IUPAC Name: 4,7-dimethoxy-N-[(2S)-1-oxo-3-phenyl-1-(1,3-thiazol-2-ylamino)propan-2-yl]-1H-indole-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-(thiazol-2-ylamino)ethyl]-4,7-dimethoxy-1H-indole-2-carboxamide Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)NC(CC3=CC=CC=C3)C(=O)NC4=NC=CS4

Isomeric SMILES

COC1=C2C=C(NC2=C(C=C1)OC)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)NC4=NC=CS4

InChI

InChI=1S/C23H22N4O4S/c1-30-18-8-9-19(31-2)20-15(18)13-17(25-20)21(28)26-16(12-14-6-4-3-5-7-14)22(29)27-23-24-10-11-32-23/h3-11,13,16,25H,12H2,1-2H3,(H,26,28)(H,24,27,29)/t16-/m0/s1