1-[3-[4-[2-ethoxy-3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propyl]phenyl]phenyl]-3-heptyl-1-methyl-urea

Systemtic Name: 1-[3-[4-[2-ethoxy-3-(4-methylpiperazin-1-yl)-3-oxidanylidene-propyl]phenyl]phenyl]-3-heptyl-1-methyl-urea Openeye Name: 1-[3-[4-[2-ethoxy-3-(4-methylpiperazin-1-yl)-3-oxo-propyl]phenyl]phenyl]-3-heptyl-1-methyl-urea CAS Name: 1-[3-[4-[2-ethoxy-3-(4-methyl-1-piperazinyl)-3-oxopropyl]phenyl]phenyl]-3-heptyl-1-methylurea IUPAC Name: 1-[3-[4-[2-ethoxy-3-(4-methylpiperazin-1-yl)-3-oxopropyl]phenyl]phenyl]-3-heptyl-1-methylurea Traditional Name: 1-[3-[4-[2-ethoxy-3-keto-3-(4-methylpiperazino)propyl]phenyl]phenyl]-3-heptyl-1-methyl-urea Formula: C31H46N4O3 MolecularWeight: 522.72194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)N(C)C1=CC=CC(=C1)C2=CC=C(C=C2)CC(C(=O)N3CCN(CC3)C)OCC

Isomeric SMILES

CCCCCCCNC(=O)N(C)C1=CC=CC(=C1)C2=CC=C(C=C2)CC(C(=O)N3CCN(CC3)C)OCC

InChI

InChI=1S/C31H46N4O3/c1-5-7-8-9-10-18-32-31(37)34(4)28-13-11-12-27(24-28)26-16-14-25(15-17-26)23-29(38-6-2)30(36)35-21-19-33(3)20-22-35/h11-17,24,29H,5-10,18-23H2,1-4H3,(H,32,37)