N-bis(1,3-thiazol-2-ylamino)phosphoryl-1-(phenylmethyl)indole-3-carboxamide

Systemtic Name: N-bis(1,3-thiazol-2-ylamino)phosphoryl-1-(phenylmethyl)indole-3-carboxamide Openeye Name: 1-benzyl-N-bis(thiazol-2-ylamino)phosphoryl-indole-3-carboxamide CAS Name: N-bis(2-thiazolylamino)phosphoryl-1-(phenylmethyl)-3-indolecarboxamide IUPAC Name: 1-benzyl-N-bis(1,3-thiazol-2-ylamino)phosphorylindole-3-carboxamide Traditional Name: 1-benzyl-N-bis(thiazol-2-ylamino)phosphoryl-indole-3-carboxamide Formula: C22H19N6O2PS2 MolecularWeight: 494.529021

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C(=O)NP(=O)(NC4=NC=CS4)NC5=NC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C(=O)NP(=O)(NC4=NC=CS4)NC5=NC=CS5

InChI

InChI=1S/C22H19N6O2PS2/c29-20(25-31(30,26-21-23-10-12-32-21)27-22-24-11-13-33-22)18-15-28(14-16-6-2-1-3-7-16)19-9-5-4-8-17(18)19/h1-13,15H,14H2,(H3,23,24,25,26,27,29,30)