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

Systemtic Name: N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-1H-indazole-3-carbothioamide Openeye Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-1H-indazole-3-carbothioamide CAS Name: N-[1-methyl-4-(phenylmethyl)-1,4-diazepan-6-yl]-1H-indazole-3-carbothioamide IUPAC Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-1H-indazole-3-carbothioamide Traditional Name: N-(1-benzyl-4-methyl-1,4-diazepan-6-yl)-1H-indazole-3-carbothioamide Formula: C21H25N5S MolecularWeight: 379.5217

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC(C1)NC(=S)C2=NNC3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC(C1)NC(=S)C2=NNC3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C21H25N5S/c1-25-11-12-26(13-16-7-3-2-4-8-16)15-17(14-25)22-21(27)20-18-9-5-6-10-19(18)23-24-20/h2-10,17H,11-15H2,1H3,(H,22,27)(H,23,24)