N-[3-[4-(1-adamantylcarbonyl)piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[4-(1-adamantylcarbonyl)piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[4-(adamantane-1-carbonyl)piperazin-1-yl]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[4-(adamantane-1-carbonyl)piperazin-1-yl]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[4-(adamantane-1-carbonyl)piperazino]-3-keto-propyl]thiophene-3-carboxamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCNC(=O)C2=CSC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1C(=O)CCNC(=O)C2=CSC=C2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H31N3O3S/c27-20(1-3-24-21(28)19-2-8-30-15-19)25-4-6-26(7-5-25)22(29)23-12-16-9-17(13-23)11-18(10-16)14-23/h2,8,15-18H,1,3-7,9-14H2,(H,24,28)