4-[4-(1-benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-pyridin-2-yl-butan-1-amine

Systemtic Name: 4-[4-(1-benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-pyridin-2-yl-butan-1-amine Openeye Name: 4-[4-(benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-(2-pyridyl)butan-1-amine CAS Name: 4-[4-(1-benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-(2-pyridinyl)-1-butanamine IUPAC Name: 4-[4-(1-benzothiophen-7-yl)-2,3-dihydropyrrol-1-yl]-1-cyclohexyl-2-pyridin-2-ylbutan-1-amine Traditional Name: [4-[3-(benzothiophen-7-yl)-2-pyrrolin-1-yl]-1-cyclohexyl-2-(2-pyridyl)butyl]amine Formula: C27H33N3S MolecularWeight: 431.63602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(CCN2CCC(=C2)C3=CC=CC4=C3SC=C4)C5=CC=CC=N5)N

Isomeric SMILES

C1CCC(CC1)C(C(CCN2CCC(=C2)C3=CC=CC4=C3SC=C4)C5=CC=CC=N5)N

InChI

InChI=1S/C27H33N3S/c28-26(20-7-2-1-3-8-20)24(25-11-4-5-15-29-25)13-17-30-16-12-22(19-30)23-10-6-9-21-14-18-31-27(21)23/h4-6,9-11,14-15,18-20,24,26H,1-3,7-8,12-13,16-17,28H2