N-[1-(1-adamantyl)ethyl]-3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-benzamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-benzamide Openeye Name: N-[1-(1-adamantyl)ethyl]-3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxy-benzamide CAS Name: N-[1-(1-adamantyl)ethyl]-3-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]-4-methoxybenzamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-4-methoxybenzamide Traditional Name: N-[1-(1-adamantyl)ethyl]-3-[4-(3-chlorophenyl)piperazino]sulfonyl-4-methoxy-benzamide Formula: C30H38ClN3O4S MolecularWeight: 572.15842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=C(C=C4)OC)S(=O)(=O)N5CCN(CC5)C6=CC(=CC=C6)Cl

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=C(C=C4)OC)S(=O)(=O)N5CCN(CC5)C6=CC(=CC=C6)Cl

InChI

InChI=1S/C30H38ClN3O4S/c1-20(30-17-21-12-22(18-30)14-23(13-21)19-30)32-29(35)24-6-7-27(38-2)28(15-24)39(36,37)34-10-8-33(9-11-34)26-5-3-4-25(31)16-26/h3-7,15-16,20-23H,8-14,17-19H2,1-2H3,(H,32,35)