N-[1-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide

Systemtic Name: N-[1-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-methoxy-benzamide Openeye Name: N-[1-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]-2-methyl-propyl]-4-methoxy-benzamide CAS Name: N-[1-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-4-methoxybenzamide IUPAC Name: N-[1-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-4-methoxybenzamide Traditional Name: N-[1-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]-2-methyl-propyl]-4-methoxy-benzamide Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC=C(S2)Cl)NC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)CC2=CC=C(S2)Cl)NC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28ClN3O3S/c1-15(2)20(24-21(27)16-4-6-17(29-3)7-5-16)22(28)26-12-10-25(11-13-26)14-18-8-9-19(23)30-18/h4-9,15,20H,10-14H2,1-3H3,(H,24,27)