4-[5-(1-adamantyl)-2-(1-benzothiophen-3-yl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-(1-adamantyl)-2-(1-benzothiophen-3-yl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-(1-adamantyl)-2-(benzothiophen-3-yl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-(1-adamantyl)-2-(1-benzothiophen-3-yl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-(1-adamantyl)-2-(1-benzothiophen-3-yl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-(1-adamantyl)-2-(benzothiophen-3-yl)-1H-indol-3-yl]butylamine Formula: C30H34N2S MolecularWeight: 454.66936

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)NC(=C5CCCCN)C6=CSC7=CC=CC=C76

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)NC(=C5CCCCN)C6=CSC7=CC=CC=C76

InChI

InChI=1S/C30H34N2S/c31-10-4-3-6-24-25-14-22(30-15-19-11-20(16-30)13-21(12-19)17-30)8-9-27(25)32-29(24)26-18-33-28-7-2-1-5-23(26)28/h1-2,5,7-9,14,18-21,32H,3-4,6,10-13,15-17,31H2