2-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)-2-phenyl-ethanone

Systemtic Name: 2-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)-2-phenyl-ethanone Openeye Name: 2-[(4-cyclopropyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)-2-phenyl-ethanone CAS Name: 2-[[4-cyclopropyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-1-(1H-indol-3-yl)-2-phenylethanone IUPAC Name: 2-[(4-cyclopropyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)-2-phenylethanone Traditional Name: 2-[(4-cyclopropyl-5-morpholino-1,2,4-triazol-3-yl)thio]-1-(1H-indol-3-yl)-2-phenyl-ethanone Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SC(C3=CC=CC=C3)C(=O)C4=CNC5=CC=CC=C54)N6CCOCC6

Isomeric SMILES

C1CC1N2C(=NN=C2SC(C3=CC=CC=C3)C(=O)C4=CNC5=CC=CC=C54)N6CCOCC6

InChI

InChI=1S/C25H25N5O2S/c31-22(20-16-26-21-9-5-4-8-19(20)21)23(17-6-2-1-3-7-17)33-25-28-27-24(30(25)18-10-11-18)29-12-14-32-15-13-29/h1-9,16,18,23,26H,10-15H2