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

Systemtic Name: 5-methyl-N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-3aH-indazole-3-carboxamide Openeye Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-5-methyl-3aH-indazole-3-carboxamide CAS Name: 5-methyl-N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-3aH-indazole-3-carboxamide IUPAC Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-5-methyl-3aH-indazole-3-carboxamide Traditional Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-5-methyl-3aH-indazole-3-carboxamide Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2C(=NN=C2C(=O)NC3CN(CCN(C3)CC4=CC=CC=C4)C)C=C1

Isomeric SMILES

CC1=CC2C(=NN=C2C(=O)NC3CN(CCN(C3)CC4=CC=CC=C4)C)C=C1

InChI

InChI=1S/C22H27N5O/c1-16-8-9-20-19(12-16)21(25-24-20)22(28)23-18-14-26(2)10-11-27(15-18)13-17-6-4-3-5-7-17/h3-9,12,18-19H,10-11,13-15H2,1-2H3,(H,23,28)