2-[4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-6-methyl-1-benzothiophen-2-yl]cyclohexa-1,3-dien-1-yl]ethanamine

Systemtic Name: 2-[4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-6-methyl-1-benzothiophen-2-yl]cyclohexa-1,3-dien-1-yl]ethanamine Openeye Name: 2-[4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-6-methyl-benzothiophen-2-yl]cyclohexa-1,3-dien-1-yl]ethanamine CAS Name: 2-[4-[3-[[3-methoxy-4-(1-pyrrolidinylmethyl)phenyl]methyl]-6-methyl-1-benzothiophen-2-yl]-1-cyclohexa-1,3-dienyl]ethanamine IUPAC Name: 2-[4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-6-methyl-1-benzothiophen-2-yl]cyclohexa-1,3-dien-1-yl]ethanamine Traditional Name: 2-[4-[3-[3-methoxy-4-(pyrrolidinomethyl)benzyl]-6-methyl-benzothiophen-2-yl]cyclohexa-1,3-dien-1-yl]ethylamine Formula: C30H36N2OS MolecularWeight: 472.68464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(CC3)CCN)CC4=CC(=C(C=C4)CN5CCCC5)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(CC3)CCN)CC4=CC(=C(C=C4)CN5CCCC5)OC

InChI

InChI=1S/C30H36N2OS/c1-21-5-12-26-27(30(34-29(26)17-21)24-9-6-22(7-10-24)13-14-31)18-23-8-11-25(28(19-23)33-2)20-32-15-3-4-16-32/h5-6,8-9,11-12,17,19H,3-4,7,10,13-16,18,20,31H2,1-2H3