1-butyl-N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]indazole-3-carboxamide

Systemtic Name: 1-butyl-N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]indazole-3-carboxamide Openeye Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-1-butyl-indazole-3-carboxamide CAS Name: 1-butyl-N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-3-indazolecarboxamide IUPAC Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-1-butylindazole-3-carboxamide Traditional Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-1-butyl-indazole-3-carboxamide Formula: C25H33N5O MolecularWeight: 419.56242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=N1)C(=O)NC3CN(CCN(C3)CC4=CC=CC=C4)C

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=N1)C(=O)NC3CN(CCN(C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H33N5O/c1-3-4-14-30-23-13-9-8-12-22(23)24(27-30)25(31)26-21-18-28(2)15-16-29(19-21)17-20-10-6-5-7-11-20/h5-13,21H,3-4,14-19H2,1-2H3,(H,26,31)