1-(1-adamantyl)-3-[3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]urea Openeye Name: 1-(1-adamantyl)-3-[3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxo-propyl]urea CAS Name: 1-(1-adamantyl)-3-[3-[2-(4-methoxyphenyl)-1-pyrrolidinyl]-3-oxopropyl]urea IUPAC Name: 1-(1-adamantyl)-3-[3-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-3-oxopropyl]urea Traditional Name: 1-(1-adamantyl)-3-[3-keto-3-[2-(4-methoxyphenyl)pyrrolidino]propyl]urea Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2C(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H35N3O3/c1-31-21-6-4-20(5-7-21)22-3-2-10-28(22)23(29)8-9-26-24(30)27-25-14-17-11-18(15-25)13-19(12-17)16-25/h4-7,17-19,22H,2-3,8-16H2,1H3,(H2,26,27,30)