azepan-1-yl-[1-ethyl-5-[(4-phenyl-1,3-thiazol-2-yl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-ethyl-5-[(4-phenyl-1,3-thiazol-2-yl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Openeye Name: azepan-1-yl-[1-ethyl-5-[(4-phenylthiazol-2-yl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone CAS Name: 1-azepanyl-[1-ethyl-5-[(4-phenyl-2-thiazolyl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone IUPAC Name: azepan-1-yl-[1-ethyl-5-[(4-phenyl-1,3-thiazol-2-yl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Traditional Name: azepan-1-yl-[1-ethyl-5-[(4-phenylthiazol-2-yl)methylamino]-4,5,6,7-tetrahydroindazol-3-yl]methanone Formula: C26H33N5OS MolecularWeight: 463.63812

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCC3=NC(=CS3)C4=CC=CC=C4)C(=N1)C(=O)N5CCCCCC5

Isomeric SMILES

CCN1C2=C(CC(CC2)NCC3=NC(=CS3)C4=CC=CC=C4)C(=N1)C(=O)N5CCCCCC5

InChI

InChI=1S/C26H33N5OS/c1-2-31-23-13-12-20(27-17-24-28-22(18-33-24)19-10-6-5-7-11-19)16-21(23)25(29-31)26(32)30-14-8-3-4-9-15-30/h5-7,10-11,18,20,27H,2-4,8-9,12-17H2,1H3