[2-(dimethylamino)-6-phenylmethoxy-1-benzothiophen-3-yl]-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methanone

Systemtic Name: [2-(dimethylamino)-6-phenylmethoxy-1-benzothiophen-3-yl]-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methanone Openeye Name: [6-benzyloxy-2-(dimethylamino)benzothiophen-3-yl]-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methanone CAS Name: [2-(dimethylamino)-6-phenylmethoxy-1-benzothiophen-3-yl]-[3-methyl-4-(1-pyrrolidinylmethyl)phenyl]methanone IUPAC Name: [2-(dimethylamino)-6-phenylmethoxy-1-benzothiophen-3-yl]-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methanone Traditional Name: [6-benzoxy-2-(dimethylamino)benzothiophen-3-yl]-[3-methyl-4-(pyrrolidinomethyl)phenyl]methanone Formula: C30H32N2O2S MolecularWeight: 484.65228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C2=C(SC3=C2C=CC(=C3)OCC4=CC=CC=C4)N(C)C)CN5CCCC5

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C2=C(SC3=C2C=CC(=C3)OCC4=CC=CC=C4)N(C)C)CN5CCCC5

InChI

InChI=1S/C30H32N2O2S/c1-21-17-23(11-12-24(21)19-32-15-7-8-16-32)29(33)28-26-14-13-25(18-27(26)35-30(28)31(2)3)34-20-22-9-5-4-6-10-22/h4-6,9-14,17-18H,7-8,15-16,19-20H2,1-3H3