[5-(1,3-benzothiazol-2-ylmethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-(1,3-benzothiazol-2-ylmethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [5-(1,3-benzothiazol-2-ylmethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [5-(1,3-benzothiazol-2-ylmethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-(1-pyrrolidinyl)methanone IUPAC Name: [5-(1,3-benzothiazol-2-ylmethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [5-(1,3-benzothiazol-2-ylmethylamino)-1-methyl-4,5,6,7-tetrahydroindazol-3-yl]-pyrrolidino-methanone Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)NCC3=NC4=CC=CC=C4S3)C(=N1)C(=O)N5CCCC5

Isomeric SMILES

CN1C2=C(CC(CC2)NCC3=NC4=CC=CC=C4S3)C(=N1)C(=O)N5CCCC5

InChI

InChI=1S/C21H25N5OS/c1-25-17-9-8-14(22-13-19-23-16-6-2-3-7-18(16)28-19)12-15(17)20(24-25)21(27)26-10-4-5-11-26/h2-3,6-7,14,22H,4-5,8-13H2,1H3