1-[1-[4-(4-dimethylaminophenyl)carbonylpiperazin-1-yl]-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)butyl]-5,5-dimethyl-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: 1-[1-[4-(4-dimethylaminophenyl)carbonylpiperazin-1-yl]-3-(1-oxidanylidene-3H-2-benzofuran-5-yl)butyl]-5,5-dimethyl-2-sulfanylidene-imidazolidin-4-one Openeye Name: 1-[1-[4-[4-(dimethylamino)benzoyl]piperazin-1-yl]-3-(1-oxo-3H-isobenzofuran-5-yl)butyl]-5,5-dimethyl-2-thioxo-imidazolidin-4-one CAS Name: 1-[1-[4-[(4-dimethylaminophenyl)-oxomethyl]-1-piperazinyl]-3-(1-oxo-3H-isobenzofuran-5-yl)butyl]-5,5-dimethyl-2-sulfanylidene-4-imidazolidinone IUPAC Name: 1-[1-[4-[4-(dimethylamino)benzoyl]piperazin-1-yl]-3-(1-oxo-3H-2-benzofuran-5-yl)butyl]-5,5-dimethyl-2-sulfanylideneimidazolidin-4-one Traditional Name: 1-[1-[4-[4-(dimethylamino)benzoyl]piperazino]-3-(1-ketophthalan-5-yl)butyl]-5,5-dimethyl-2-thioxo-4-imidazolidinone Formula: C30H37N5O4S MolecularWeight: 563.71088

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(N1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)C)N3C(=S)NC(=O)C3(C)C)C4=CC5=C(C=C4)C(=O)OC5

Isomeric SMILES

CC(CC(N1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)C)N3C(=S)NC(=O)C3(C)C)C4=CC5=C(C=C4)C(=O)OC5

InChI

InChI=1S/C30H37N5O4S/c1-19(21-8-11-24-22(17-21)18-39-27(24)37)16-25(35-29(40)31-28(38)30(35,2)3)33-12-14-34(15-13-33)26(36)20-6-9-23(10-7-20)32(4)5/h6-11,17,19,25H,12-16,18H2,1-5H3,(H,31,38,40)