1-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3-naphthalen-1-yl-urea

Systemtic Name: 1-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3-naphthalen-1-yl-urea Openeye Name: 1-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3-(1-naphthyl)urea CAS Name: 1-[4-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazinyl]phenyl]-3-(1-naphthalenyl)urea IUPAC Name: 1-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]-3-naphthalen-1-ylurea Traditional Name: 1-[4-[4-(3,3-dimethylbutanoyl)piperazino]phenyl]-3-(1-naphthyl)urea Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H32N4O2/c1-27(2,3)19-25(32)31-17-15-30(16-18-31)22-13-11-21(12-14-22)28-26(33)29-24-10-6-8-20-7-4-5-9-23(20)24/h4-14H,15-19H2,1-3H3,(H2,28,29,33)